AF00785
160017-00-5 | 6-(Isopropylamino)pyridine-3-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AF00785
ChemicalName
6-(Isopropylamino)pyridine-3-carbonitrile
CasNumber
160017-00-5
MolecularFormula
C9H11N3
MolecularWeight
161.2037
MdlNumber
MFCD09944214
Smiles
N#Cc1ccc(nc1)NC(C)C
Complexity
180
Covalently-bondedUnitCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
1.7
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CatalogNumber: AF00785
ChemicalName: 6-(Isopropylamino)pyridine-3-carbonitrile
CasNumber: 160017-00-5
MolecularFormula: C9H11N3
MolecularWeight: 161.2037
MdlNumber: MFCD09944214
Smiles: N#Cc1ccc(nc1)NC(C)C
Complexity: 180
Covalently-bondedUnitCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 1.7
CatalogNumber:
AF00785
ChemicalName:
6-(Isopropylamino)pyridine-3-carbonitrile
CasNumber:
160017-00-5
MolecularFormula:
C9H11N3
MolecularWeight:
161.2037
MdlNumber:
MFCD09944214
Smiles:
N#Cc1ccc(nc1)NC(C)C
Complexity:
180
Covalently-bondedUnitCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
1.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCCCNc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCCCNc1cc(ccc1S(=O)(=O)C)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF00788
ChemicalName: 4-Methoxy-3,5-dimethylaniline HCl
CasNumber: 158400-44-3
MolecularFormula: C9H14ClNO
MolecularWeight: 187.6666
MdlNumber: MFCD22586681
Smiles: COc1c(C)cc(cc1C)N.Cl
Complexity: 115
Covalently-bondedUnitCount: 2
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: __
CatalogNumber:
AF00788
ChemicalName:
4-Methoxy-3,5-dimethylaniline HCl
CasNumber:
158400-44-3
MolecularFormula:
C9H14ClNO
MolecularWeight:
187.6666
MdlNumber:
MFCD22586681
Smiles:
COc1c(C)cc(cc1C)N.Cl
Complexity:
115
Covalently-bondedUnitCount:
2
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
__
CatalogNumber: AF00789
ChemicalName: 3-Methoxy-2-(4-methoxybenzylamino)benzonitrile
CasNumber: 1437794-83-6
MolecularFormula: C16H16N2O2
MolecularWeight: 268.3104
MdlNumber: MFCD24448808
Smiles: COc1ccc(cc1)CNc1c(OC)cccc1C#N
Complexity: 331
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 3.6
CatalogNumber:
AF00789
ChemicalName:
3-Methoxy-2-(4-methoxybenzylamino)benzonitrile
CasNumber:
1437794-83-6
MolecularFormula:
C16H16N2O2
MolecularWeight:
268.3104
MdlNumber:
MFCD24448808
Smiles:
COc1ccc(cc1)CNc1c(OC)cccc1C#N
Complexity:
331
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
3.6