AA65340
147081-59-2 | tert-Butyl (3S)-3-(methylamino)pyrrolidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA65340
ChemicalName
tert-Butyl (3S)-3-(methylamino)pyrrolidine-1-carboxylate
CasNumber
147081-59-2
MolecularFormula
C10H20N2O2
MolecularWeight
200.278
MdlNumber
MFCD09752962
Smiles
CN[C@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity
211
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
0.9
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CatalogNumber: AA65340
ChemicalName: tert-Butyl (3S)-3-(methylamino)pyrrolidine-1-carboxylate
CasNumber: 147081-59-2
MolecularFormula: C10H20N2O2
MolecularWeight: 200.278
MdlNumber: MFCD09752962
Smiles: CN[C@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity: 211
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 0.9
CatalogNumber:
AA65340
ChemicalName:
tert-Butyl (3S)-3-(methylamino)pyrrolidine-1-carboxylate
CasNumber:
147081-59-2
MolecularFormula:
C10H20N2O2
MolecularWeight:
200.278
MdlNumber:
MFCD09752962
Smiles:
CN[C@H]1CCN(C1)C(=O)OC(C)(C)C
Complexity:
211
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
0.9
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(ON1C(=O)CCC1=O)CCCCCCCCCCSSCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(ON1C(=O)CCC1=O)CCCCCCCCCCSSCCCCCCCCCCC(=O)ON1C(=O)CCC1=O
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(OCC1c2ccccc2-c2c1cccc2)NCCC[C@@H](C(=O)O)N
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(OCC1c2ccccc2-c2c1cccc2)NCCC[C@@H](C(=O)O)N
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA65347
ChemicalName: Methyl 1h-pyrrolo[2,3-c]pyridine-5-carboxylate
CasNumber: 147071-00-9
MolecularFormula: C9H8N2O2
MolecularWeight: 176.172
MdlNumber: MFCD07778440
Smiles: COC(=O)c1cc2cc[nH]c2cn1
Complexity: 208
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 13
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.2
CatalogNumber:
AA65347
ChemicalName:
Methyl 1h-pyrrolo[2,3-c]pyridine-5-carboxylate
CasNumber:
147071-00-9
MolecularFormula:
C9H8N2O2
MolecularWeight:
176.172
MdlNumber:
MFCD07778440
Smiles:
COC(=O)c1cc2cc[nH]c2cn1
Complexity:
208
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
13
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.2