N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide

C14H13ClN2O — CID 19224279

IUPACN-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cc(C)c(NC(=O)c2ccccn2)c(Cl)c1
InChIInChI=1S/C14H13ClN2O/c1-9-7-10(2)13(11(15)8-9)17-14(18)12-5-3-4-6-16-12/h3-8H,1-2H3,(H,17,18)
InChIKeyOBXZNCIYRAATSY-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.60
Rot. Bonds2

About N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide

N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide (PubChem CID 19224279) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
PubChem CID19224279
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC NameN-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
SMILESCc1cc(C)c(NC(=O)c2ccccn2)c(Cl)c1
InChIInChI=1S/C14H13ClN2O/c1-9-7-10(2)13(11(15)8-9)17-14(18)12-5-3-4-6-16-12/h3-8H,1-2H3,(H,17,18)
InChIKeyOBXZNCIYRAATSY-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-(2-chloro-6-methyl-4-sulfamoylphenyl)pyridine-2-carboxamide
CID 66254800
6-N-(2-chloro-4,6-dimethylphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099984
N-(2-chloro-4,6-dimethylphenyl)-4-(propan-2-ylamino)pyridine-2-carboxamide
CID 109201606
N-(2-chloro-4,6-dimethylphenyl)-2-(pyridin-2-ylmethylamino)pyridine-4-carboxamide
CID 109171754
2-bromo-N-(2-chloro-4,6-dimethylphenyl)benzamide
CID 731571
3,5-dimethyl-4-(pyridine-2-carbonylamino)benzenesulfonyl chloride
CID 43102261
4-(3-acetylanilino)-N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
CID 109221343
N-(2-chloro-4,6-dimethylphenyl)-4-(cyclopentylamino)pyridine-2-carboxamide
CID 109204288
N-(2-chloro-4,6-dimethylphenyl)naphthalene-2-carboxamide
CID 7749916
4-(butan-2-ylamino)-N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide
CID 109203542
N-(2-chloro-4,6-dimethylphenyl)-4-(2-methoxyethylamino)pyridine-2-carboxamide
CID 109205952
N-(2-chloro-4,6-dimethylphenyl)-4-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109081130

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide?
The IUPAC name of N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide (CID 19224279) is N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide?
The canonical SMILES for N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide is Cc1cc(C)c(NC(=O)c2ccccn2)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide?
The InChIKey is OBXZNCIYRAATSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c1-9-7-10(2)13(11(15)8-9)17-14(18)12-5-3-4-6-16-12/h3-8H,1-2H3,(H,17,18).
What are the key properties of N-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide?
N-(2-chloro-4,6-dimethylphenyl)pyridine-2-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-(2-chloro-4,6-dimethylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 19224279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).