AI05317
1016788-06-9 | 3-Cyano-N-cyclopropylbenzamide
Manufacturer: A2B Chem
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CatalogNumber
AI05317
ChemicalName
3-Cyano-N-cyclopropylbenzamide
CasNumber
1016788-06-9
MolecularFormula
C11H10N2O
MolecularWeight
186.2099
MdlNumber
MFCD09946575
Smiles
N#Cc1cccc(c1)C(=O)NC1CC1
Complexity
274
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
2
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.8
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CatalogNumber: AI05317
ChemicalName: 3-Cyano-N-cyclopropylbenzamide
CasNumber: 1016788-06-9
MolecularFormula: C11H10N2O
MolecularWeight: 186.2099
MdlNumber: MFCD09946575
Smiles: N#Cc1cccc(c1)C(=O)NC1CC1
Complexity: 274
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.8
CatalogNumber:
AI05317
ChemicalName:
3-Cyano-N-cyclopropylbenzamide
CasNumber:
1016788-06-9
MolecularFormula:
C11H10N2O
MolecularWeight:
186.2099
MdlNumber:
MFCD09946575
Smiles:
N#Cc1cccc(c1)C(=O)NC1CC1
Complexity:
274
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.8
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Smiles: CNCC(=O)NCCN(C)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
Xlogp3: __
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Smiles:
CNCC(=O)NCCN(C)C
Complexity:
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HydrogenBondDonorCount:
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RotatableBondCount:
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Smiles: O=C1CCN(CC1)C(=O)c1cccc(c1)Br
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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:
O=C1CCN(CC1)C(=O)c1cccc(c1)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
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Smiles: CNC(c1ccc(c(c1)F)OC)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNC(c1ccc(c(c1)F)OC)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__