AA56629
138022-02-3 | tert-butyl 4-[(methylamino)methyl]piperidine-1-carboxylate
Manufacturer: A2B Chem
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CatalogNumber
AA56629
ChemicalName
tert-butyl 4-[(methylamino)methyl]piperidine-1-carboxylate
CasNumber
138022-02-3
MolecularFormula
C12H24N2O2
MolecularWeight
228.33116000000007
MdlNumber
MFCD06656629
Smiles
CNCC1CCN(CC1)C(=O)OC(C)(C)C
Complexity
228
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
4
Xlogp3
1.4
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CatalogNumber: AA56629
ChemicalName: tert-butyl 4-[(methylamino)methyl]piperidine-1-carboxylate
CasNumber: 138022-02-3
MolecularFormula: C12H24N2O2
MolecularWeight: 228.33116000000007
MdlNumber: MFCD06656629
Smiles: CNCC1CCN(CC1)C(=O)OC(C)(C)C
Complexity: 228
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.4
CatalogNumber:
AA56629
ChemicalName:
tert-butyl 4-[(methylamino)methyl]piperidine-1-carboxylate
CasNumber:
138022-02-3
MolecularFormula:
C12H24N2O2
MolecularWeight:
228.33116000000007
MdlNumber:
MFCD06656629
Smiles:
CNCC1CCN(CC1)C(=O)OC(C)(C)C
Complexity:
228
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.4
CatalogNumber: __
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Smiles: CN(CC1CCNCC1)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
CN(CC1CCNCC1)C
Complexity:
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RotatableBondCount:
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Smiles: CSC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity: __
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Smiles:
CSC[C@@H](C(=O)O)NC(=O)OCC1c2ccccc2-c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: COc1cc(cc2c1cccc2)[N+](=O)[O-]
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
COc1cc(cc2c1cccc2)[N+](=O)[O-]
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
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