4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide

C20H15ClN4O — CID 109221189

IUPAC4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
SMILESCc1ccc(Cl)cc1Nc1ccnc(C(=O)Nc2ccccc2C#N)c1
InChIInChI=1S/C20H15ClN4O/c1-13-6-7-15(21)10-18(13)24-16-8-9-23-19(11-16)20(26)25-17-5-3-2-4-14(17)12-22/h2-11H,1H3,(H,23,24)(H,25,26)
InChIKeyGAUDWYCDFQFBNU-UHFFFAOYSA-N
MW362.82 g/mol
LogP4.91
Rot. Bonds4

About 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide

4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide (PubChem CID 109221189) has the molecular formula C20H15ClN4O and a molecular weight of 362.82 g/mol. Its IUPAC name is 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
PubChem CID109221189
Molecular FormulaC20H15ClN4O
Molecular Weight362.82 g/mol
Exact Mass362.09
IUPAC Name4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
SMILESCc1ccc(Cl)cc1Nc1ccnc(C(=O)Nc2ccccc2C#N)c1
InChIInChI=1S/C20H15ClN4O/c1-13-6-7-15(21)10-18(13)24-16-8-9-23-19(11-16)20(26)25-17-5-3-2-4-14(17)12-22/h2-11H,1H3,(H,23,24)(H,25,26)
InChIKeyGAUDWYCDFQFBNU-UHFFFAOYSA-N
XLogP4.91
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.82
LogP ≤ 54.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-chloro-2-methylphenyl)-4-(2-cyanoanilino)pyridine-2-carboxamide
CID 109221213
4-(2-cyanoanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide
CID 109222697
4-(2-cyanoanilino)-N-(2,5-dimethylphenyl)pyridine-2-carboxamide
CID 109219824
6-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyrimidine-4-carboxamide
CID 109358385
N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide
CID 109220187
N-(2-cyanophenyl)-4-(2,3-dichloroanilino)pyridine-2-carboxamide
CID 109222663
4-(2-cyanoanilino)-N-(3,5-dimethylphenyl)pyridine-2-carboxamide
CID 109219956
4-(2-cyanoanilino)-N-(2,3,4-trifluorophenyl)pyridine-2-carboxamide
CID 109222708
methyl 2-[[2-[(5-chloro-2-methylphenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109221157
2-N-(2-cyanophenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091043
ethyl 2-[[2-[(2-cyanophenyl)carbamoyl]-4-pyridinyl]amino]benzoate
CID 109222691
N-(2-cyanophenyl)-4-[2-(trifluoromethyl)anilino]pyridine-2-carboxamide
CID 109222061

Frequently Asked Questions

What is the IUPAC name of 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide?
The IUPAC name of 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide (CID 109221189) is 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide is Cc1ccc(Cl)cc1Nc1ccnc(C(=O)Nc2ccccc2C#N)c1.
What is the InChIKey of 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide?
The InChIKey is GAUDWYCDFQFBNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O/c1-13-6-7-15(21)10-18(13)24-16-8-9-23-19(11-16)20(26)25-17-5-3-2-4-14(17)12-22/h2-11H,1H3,(H,23,24)(H,25,26).
What are the key properties of 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide?
4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide has a molecular weight of 362.82 g/mol, XLogP of 4.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-chloro-2-methylanilino)-N-(2-cyanophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109221189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).