6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide

C20H15ClN4O — CID 109156828

IUPAC6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide
SMILESN#Cc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)nc2)c1
InChIInChI=1S/C20H15ClN4O/c21-18-7-2-1-5-15(18)12-23-19-9-8-16(13-24-19)20(26)25-17-6-3-4-14(10-17)11-22/h1-10,13H,12H2,(H,23,24)(H,25,26)
InChIKeyWFPRIWZYDQATAJ-UHFFFAOYSA-N
MW362.82 g/mol
LogP4.47
Rot. Bonds5

About 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide

6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide (PubChem CID 109156828) has the molecular formula C20H15ClN4O and a molecular weight of 362.82 g/mol. Its IUPAC name is 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide
PubChem CID109156828
Molecular FormulaC20H15ClN4O
Molecular Weight362.82 g/mol
Exact Mass362.09
IUPAC Name6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide
SMILESN#Cc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)nc2)c1
InChIInChI=1S/C20H15ClN4O/c21-18-7-2-1-5-15(18)12-23-19-9-8-16(13-24-19)20(26)25-17-6-3-4-14(10-17)11-22/h1-10,13H,12H2,(H,23,24)(H,25,26)
InChIKeyWFPRIWZYDQATAJ-UHFFFAOYSA-N
XLogP4.47
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.82
LogP ≤ 54.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-chlorophenyl)-6-[(2-chlorophenyl)methylamino]pyridine-3-carboxamide
CID 109156799
6-(3-chloro-2-methylanilino)-N-(3-cyanophenyl)pyridine-3-carboxamide
CID 109163549
N-[(2-chlorophenyl)methyl]-2-(3-cyanoanilino)pyrimidine-5-carboxamide
CID 109257471
6-[(2-chlorophenyl)methylamino]-N-(2-methylphenyl)pyridine-3-carboxamide
CID 109156789
4-tert-butyl-N-[6-[(2-chlorophenyl)methylamino]-3-pyridinyl]benzamide
CID 113012213
6-(4-tert-butylanilino)-N-(3-cyanophenyl)pyridine-3-carboxamide
CID 109163157
5-[(2-chlorophenyl)methylamino]-N-(4-cyanophenyl)pyridine-3-carboxamide
CID 109233968
N-(3-chloro-4-fluorophenyl)-6-[(2-methylphenyl)methylamino]pyridine-3-carboxamide
CID 109155687
N-(3-chlorophenyl)-5-[(2-chlorophenyl)methylamino]pyrazine-2-carboxamide
CID 109281944
N-(3-cyanophenyl)-6-(3,4-difluoroanilino)pyridine-3-carboxamide
CID 109165005
N-[(2-chlorophenyl)methyl]-5-(3-cyanoanilino)pyridine-3-carboxamide
CID 109233871
N-[(2-chlorophenyl)methyl]-2-(3-cyanoanilino)pyridine-4-carboxamide
CID 109170782

Frequently Asked Questions

What is the IUPAC name of 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide?
The IUPAC name of 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide (CID 109156828) is 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide is N#Cc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)nc2)c1.
What is the InChIKey of 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide?
The InChIKey is WFPRIWZYDQATAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O/c21-18-7-2-1-5-15(18)12-23-19-9-8-16(13-24-19)20(26)25-17-6-3-4-14(10-17)11-22/h1-10,13H,12H2,(H,23,24)(H,25,26).
What are the key properties of 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide?
6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide has a molecular weight of 362.82 g/mol, XLogP of 4.47, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-chlorophenyl)methylamino]-N-(3-cyanophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109156828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).