AB76451
86847-64-5 | N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide
Manufacturer: A2B Chem
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CatalogNumber
AB76451
ChemicalName
N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide
CasNumber
86847-64-5
MolecularFormula
C11H14N2O2
MolecularWeight
206.2411
MdlNumber
MFCD01830170
Smiles
O=Cc1cccnc1NC(=O)C(C)(C)C
Complexity
246
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.8
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CatalogNumber: AB76451
ChemicalName: N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide
CasNumber: 86847-64-5
MolecularFormula: C11H14N2O2
MolecularWeight: 206.2411
MdlNumber: MFCD01830170
Smiles: O=Cc1cccnc1NC(=O)C(C)(C)C
Complexity: 246
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AB76451
ChemicalName:
N-(3-Formyl-2-pyridinyl)-2,2-dimethylpropanamide
CasNumber:
86847-64-5
MolecularFormula:
C11H14N2O2
MolecularWeight:
206.2411
MdlNumber:
MFCD01830170
Smiles:
O=Cc1cccnc1NC(=O)C(C)(C)C
Complexity:
246
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: AB76452
ChemicalName: N-(3-Hydroxypropyl)ethylenediamine
CasNumber: 56344-32-2
MolecularFormula: C5H14N2O
MolecularWeight: 118.1775
MdlNumber: MFCD00059848
Smiles: NCCNCCCO
Complexity: 41.4
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 3
RotatableBondCount: 5
Xlogp3: -1.5
CatalogNumber:
AB76452
ChemicalName:
N-(3-Hydroxypropyl)ethylenediamine
CasNumber:
56344-32-2
MolecularFormula:
C5H14N2O
MolecularWeight:
118.1775
MdlNumber:
MFCD00059848
Smiles:
NCCNCCCO
Complexity:
41.4
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
3
RotatableBondCount:
5
Xlogp3:
-1.5
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Smiles: OCCCNC(=O)C(F)(F)F
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OCCCNC(=O)C(F)(F)F
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Smiles: O=C(Cc1c[nH]c2c1cccc2)N[C@H](C(=O)O)C
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Smiles:
O=C(Cc1c[nH]c2c1cccc2)N[C@H](C(=O)O)C
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Xlogp3:
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