N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide

C13H11ClN2O — CID 110858745

IUPACN-(2-chlorophenyl)-4-methylpyridine-2-carboxamide
SMILESCc1ccnc(C(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C13H11ClN2O/c1-9-6-7-15-12(8-9)13(17)16-11-5-3-2-4-10(11)14/h2-8H,1H3,(H,16,17)
InChIKeyBUGHMCAQSBPHRA-UHFFFAOYSA-N
MW246.70 g/mol
LogP3.30
Rot. Bonds2

About N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide

N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide (PubChem CID 110858745) has the molecular formula C13H11ClN2O and a molecular weight of 246.70 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-methylpyridine-2-carboxamide
PubChem CID110858745
Molecular FormulaC13H11ClN2O
Molecular Weight246.70 g/mol
Exact Mass246.06
IUPAC NameN-(2-chlorophenyl)-4-methylpyridine-2-carboxamide
SMILESCc1ccnc(C(=O)Nc2ccccc2Cl)c1
InChIInChI=1S/C13H11ClN2O/c1-9-6-7-15-12(8-9)13(17)16-11-5-3-2-4-10(11)14/h2-8H,1H3,(H,16,17)
InChIKeyBUGHMCAQSBPHRA-UHFFFAOYSA-N
XLogP3.30
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.70
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chlorophenyl)-4-methylpyridine-2-carbothioamide
CID 134122710
N-(2-chlorophenyl)-4,6-dimethylpyridine-2-carboxamide
CID 19224329
4-N-(2-chlorophenyl)-2-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092151
2-N-(2-chlorophenyl)-4-N,4-N-dipropylpyridine-2,4-dicarboxamide
CID 109090478
4-N-(2-chlorophenyl)-2-N-(3,4-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109091921
2-N-(2-chlorophenyl)-4-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092591
4-(3-acetamidoanilino)-N-(2-chlorophenyl)pyridine-2-carboxamide
CID 109220873
4-chloro-N-[2-[(4-chloropyridine-2-carbonyl)amino]phenyl]pyridine-2-carboxamide
CID 102274363
N-(2-chlorophenyl)-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080420
2-N-(2-chlorophenyl)-4-N-[(2-methylphenyl)methyl]pyridine-2,4-dicarboxamide
CID 109085561
N-(2-chlorophenyl)-3-methylbenzamide
CID 675649
2-N-(2-chlorophenyl)-4-N-(4-propan-2-ylphenyl)pyridine-2,4-dicarboxamide
CID 109092468

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide (CID 110858745) is N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide is Cc1ccnc(C(=O)Nc2ccccc2Cl)c1.
What is the InChIKey of N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide?
The InChIKey is BUGHMCAQSBPHRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN2O/c1-9-6-7-15-12(8-9)13(17)16-11-5-3-2-4-10(11)14/h2-8H,1H3,(H,16,17).
What are the key properties of N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide?
N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide has a molecular weight of 246.70 g/mol, XLogP of 3.30, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-methylpyridine-2-carboxamide is sourced from PubChem (CID 110858745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).