6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide

C20H15ClN4O — CID 109163592

IUPAC6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide
SMILESCc1ccc(Cl)cc1Nc1ccc(C(=O)Nc2ccc(C#N)cc2)cn1
InChIInChI=1S/C20H15ClN4O/c1-13-2-6-16(21)10-18(13)25-19-9-5-15(12-23-19)20(26)24-17-7-3-14(11-22)4-8-17/h2-10,12H,1H3,(H,23,25)(H,24,26)
InChIKeyNREOPCPEZSRNPT-UHFFFAOYSA-N
MW362.82 g/mol
LogP4.91
Rot. Bonds4

About 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide

6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide (PubChem CID 109163592) has the molecular formula C20H15ClN4O and a molecular weight of 362.82 g/mol. Its IUPAC name is 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide
PubChem CID109163592
Molecular FormulaC20H15ClN4O
Molecular Weight362.82 g/mol
Exact Mass362.09
IUPAC Name6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide
SMILESCc1ccc(Cl)cc1Nc1ccc(C(=O)Nc2ccc(C#N)cc2)cn1
InChIInChI=1S/C20H15ClN4O/c1-13-2-6-16(21)10-18(13)25-19-9-5-15(12-23-19)20(26)24-17-7-3-14(11-22)4-8-17/h2-10,12H,1H3,(H,23,25)(H,24,26)
InChIKeyNREOPCPEZSRNPT-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

methyl 4-[[6-(5-chloro-2-methylanilino)pyridine-3-carbonyl]amino]benzoate
CID 109163584
N-(3-acetylphenyl)-6-(5-chloro-2-methylanilino)pyridine-3-carboxamide
CID 109163578
N-(1,3-benzodioxol-5-yl)-6-(5-chloro-2-methylanilino)pyridine-3-carboxamide
CID 109163587
N-(4-acetamidophenyl)-6-(4-cyanoanilino)pyridine-3-carboxamide
CID 109164577
methyl 4-[[5-[(4-cyanophenyl)carbamoyl]-2-pyridinyl]amino]benzoate
CID 109164642
6-(4-bromoanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide
CID 109163836
N-(5-chloro-2-methylphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 55042675
N-(4-cyanophenyl)-6-[4-(dimethylamino)anilino]pyridine-3-carboxamide
CID 109164675
6-(3-chloro-2-methylanilino)-N-(3-cyanophenyl)pyridine-3-carboxamide
CID 109163549
6-chloro-N-(5-cyano-2-methylphenyl)pyridine-3-carboxamide
CID 47475855
4-N-(4-chlorophenyl)-1-N-(4-cyanophenyl)benzene-1,4-dicarboxamide
CID 109049994
6-(4-chloro-2-methylanilino)-N-(4-cyanophenyl)-2-methylpyrimidine-4-carboxamide
CID 112850278

Frequently Asked Questions

What is the IUPAC name of 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide (CID 109163592) is 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide is Cc1ccc(Cl)cc1Nc1ccc(C(=O)Nc2ccc(C#N)cc2)cn1.
What is the InChIKey of 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide?
The InChIKey is NREOPCPEZSRNPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O/c1-13-2-6-16(21)10-18(13)25-19-9-5-15(12-23-19)20(26)24-17-7-3-14(11-22)4-8-17/h2-10,12H,1H3,(H,23,25)(H,24,26).
What are the key properties of 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide?
6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-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 6-(5-chloro-2-methylanilino)-N-(4-cyanophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109163592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).