N-(2,3-dimethylphenyl)pyridine-2-carboxamide

C14H14N2O — CID 2599699

IUPACN-(2,3-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccccn2)c1C
InChIInChI=1S/C14H14N2O/c1-10-6-5-8-12(11(10)2)16-14(17)13-7-3-4-9-15-13/h3-9H,1-2H3,(H,16,17)
InChIKeyWKSHRCZDRCYJIW-UHFFFAOYSA-N
MW226.28 g/mol
LogP2.95
Rot. Bonds2

About N-(2,3-dimethylphenyl)pyridine-2-carboxamide

N-(2,3-dimethylphenyl)pyridine-2-carboxamide (PubChem CID 2599699) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)pyridine-2-carboxamide
PubChem CID2599699
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC NameN-(2,3-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccccn2)c1C
InChIInChI=1S/C14H14N2O/c1-10-6-5-8-12(11(10)2)16-14(17)13-7-3-4-9-15-13/h3-9H,1-2H3,(H,16,17)
InChIKeyWKSHRCZDRCYJIW-UHFFFAOYSA-N
XLogP2.95
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-pyridyl)benzamide
CID 78893
Bupicomide
CID 31447
PARP Inhibitor XIV
CID 25113764
Lsn2463359
CID 72551298
Piberaline
CID 65975
N-(3-(trifluoromethyl)phenyl)pyridine-2-carboxamide
CID 2306530
N,N'-(2,2'-Dimethyl-[1,1'-biphenyl]-3,3'-diyl)bis(5-(((2-hydroxyethyl)amino)methyl)picolinamide)
CID 139537190
Pyridine-2-carboxylic acid (2-amino-phenyl)-amide
CID 817096
N'-{(E)-[4-(dimethylamino)phenyl]methylidene}pyridine-2-carbohydrazide
CID 6878849
WO2017106634, Example 33
CID 129240409
4-Methyl-N-4-pyridinylbenzamide
CID 84517
Picolinic acid, 2-benzylhydrazide
CID 73101

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)pyridine-2-carboxamide (CID 2599699) is N-(2,3-dimethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)pyridine-2-carboxamide is Cc1cccc(NC(=O)c2ccccn2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
The InChIKey is WKSHRCZDRCYJIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-10-6-5-8-12(11(10)2)16-14(17)13-7-3-4-9-15-13/h3-9H,1-2H3,(H,16,17).
What are the key properties of N-(2,3-dimethylphenyl)pyridine-2-carboxamide?
N-(2,3-dimethylphenyl)pyridine-2-carboxamide has a molecular weight of 226.28 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 2599699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).