AE61925
1352318-64-9 | 2-(4-Aminophenyl)pyridine-3-carbonitrile
Manufacturer: A2B Chem
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CatalogNumber
AE61925
ChemicalName
2-(4-Aminophenyl)pyridine-3-carbonitrile
CasNumber
1352318-64-9
MolecularFormula
C12H9N3
MolecularWeight
195.22
MdlNumber
MFCD20491462
Smiles
N#Cc1cccnc1c1ccc(cc1)N
Complexity
247
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.6
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CatalogNumber: AE61925
ChemicalName: 2-(4-Aminophenyl)pyridine-3-carbonitrile
CasNumber: 1352318-64-9
MolecularFormula: C12H9N3
MolecularWeight: 195.22
MdlNumber: MFCD20491462
Smiles: N#Cc1cccnc1c1ccc(cc1)N
Complexity: 247
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.6
CatalogNumber:
AE61925
ChemicalName:
2-(4-Aminophenyl)pyridine-3-carbonitrile
CasNumber:
1352318-64-9
MolecularFormula:
C12H9N3
MolecularWeight:
195.22
MdlNumber:
MFCD20491462
Smiles:
N#Cc1cccnc1c1ccc(cc1)N
Complexity:
247
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.6
CatalogNumber: AE61926
ChemicalName: Methyl 3-cyano-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
CasNumber: 1352413-06-9
MolecularFormula: C15H18BNO4
MolecularWeight: 287.1187
MdlNumber: MFCD18373989
Smiles: COC(=O)c1cc(cc(c1)C#N)B1OC(C(O1)(C)C)(C)C
Complexity: 452
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: __
RotatableBondCount: 3
Xlogp3: __
CatalogNumber:
AE61926
ChemicalName:
Methyl 3-cyano-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
CasNumber:
1352413-06-9
MolecularFormula:
C15H18BNO4
MolecularWeight:
287.1187
MdlNumber:
MFCD18373989
Smiles:
COC(=O)c1cc(cc(c1)C#N)B1OC(C(O1)(C)C)(C)C
Complexity:
452
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
__
RotatableBondCount:
3
Xlogp3:
__
CatalogNumber: AE61928
ChemicalName: 4-(BOC-Amino)-1-butanoylpiperidine
CasNumber: 1352318-26-3
MolecularFormula: C14H26N2O3
MolecularWeight: 270.3678
MdlNumber: MFCD20529528
Smiles: CCCC(=O)N1CCC(CC1)NC(=O)OC(C)(C)C
Complexity: 315
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 5
Xlogp3: 1.8
CatalogNumber:
AE61928
ChemicalName:
4-(BOC-Amino)-1-butanoylpiperidine
CasNumber:
1352318-26-3
MolecularFormula:
C14H26N2O3
MolecularWeight:
270.3678
MdlNumber:
MFCD20529528
Smiles:
CCCC(=O)N1CCC(CC1)NC(=O)OC(C)(C)C
Complexity:
315
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
5
Xlogp3:
1.8
CatalogNumber: AE61929
ChemicalName: 2-(3-Fluorophenyl)benzonitrile
CasNumber: 1352318-38-7
MolecularFormula: C13H8FN
MolecularWeight: 197.2077
MdlNumber: MFCD05980284
Smiles: N#Cc1ccccc1c1cccc(c1)F
Complexity: 255
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: __
RotatableBondCount: 1
Xlogp3: 3.6
CatalogNumber:
AE61929
ChemicalName:
2-(3-Fluorophenyl)benzonitrile
CasNumber:
1352318-38-7
MolecularFormula:
C13H8FN
MolecularWeight:
197.2077
MdlNumber:
MFCD05980284
Smiles:
N#Cc1ccccc1c1cccc(c1)F
Complexity:
255
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
__
RotatableBondCount:
1
Xlogp3:
3.6