N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide

C14H13ClN2O — CID 110859088

IUPACN-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)c1cccnc1C
InChIInChI=1S/C14H13ClN2O/c1-9-5-6-11(15)8-13(9)17-14(18)12-4-3-7-16-10(12)2/h3-8H,1-2H3,(H,17,18)
InChIKeyPELFLWFSQDRKNA-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.60
Rot. Bonds2

About N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide

N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide (PubChem CID 110859088) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
PubChem CID110859088
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC NameN-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide
SMILESCc1ccc(Cl)cc1NC(=O)c1cccnc1C
InChIInChI=1S/C14H13ClN2O/c1-9-5-6-11(15)8-13(9)17-14(18)12-4-3-7-16-10(12)2/h3-8H,1-2H3,(H,17,18)
InChIKeyPELFLWFSQDRKNA-UHFFFAOYSA-N
XLogP3.60
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-chloro-2-(trifluoromethyl)phenyl]-2-methylpyridine-3-carboxamide
CID 110863795
2-(azepan-1-yl)-N-(5-chloro-2-methylphenyl)pyridine-3-carboxamide
CID 84576944
2-chloro-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 9097781
2-[(5-chloro-2-methylbenzoyl)amino]pyridine-3-carboxylic acid
CID 82881193
N-(5-chloro-2-methylphenyl)-2-phenylbenzamide
CID 976295
N-(5-chloro-2-methylphenyl)-2-methylpyrimidine-4-carboxamide
CID 47255494
4-[(5-chloro-2-methylphenyl)carbamoyl]pyridine-3-carboxylic acid
CID 53270772
N-(5-chloro-2-methylphenyl)-6-methyl-4-(methylamino)pyridine-3-carboxamide
CID 81233865
4-amino-N-(5-chloro-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81233570
N-(5-bromo-4-fluoro-2-methylphenyl)-2-chloropyridine-3-carboxamide
CID 103274583
2-(benzenesulfonamido)-N-(5-chloro-2-methylphenyl)benzamide
CID 2977231
N-(5-chloro-2-methylphenyl)-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105383965

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide (CID 110859088) is N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide is Cc1ccc(Cl)cc1NC(=O)c1cccnc1C.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide?
The InChIKey is PELFLWFSQDRKNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c1-9-5-6-11(15)8-13(9)17-14(18)12-4-3-7-16-10(12)2/h3-8H,1-2H3,(H,17,18).
What are the key properties of N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide?
N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide has a molecular weight of 260.72 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 110859088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).