2-(4-chlorophenyl)pyridine-3-carboxamide

C12H9ClN2O — CID 140983292

IUPAC2-(4-chlorophenyl)pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1-c1ccc(Cl)cc1
InChIInChI=1S/C12H9ClN2O/c13-9-5-3-8(4-6-9)11-10(12(14)16)2-1-7-15-11/h1-7H,(H2,14,16)
InChIKeyIYSOHERDRNKJAD-UHFFFAOYSA-N
MW232.67 g/mol
LogP2.50
Rot. Bonds2

About 2-(4-chlorophenyl)pyridine-3-carboxamide

2-(4-chlorophenyl)pyridine-3-carboxamide (PubChem CID 140983292) has the molecular formula C12H9ClN2O and a molecular weight of 232.67 g/mol. Its IUPAC name is 2-(4-chlorophenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)pyridine-3-carboxamide
PubChem CID140983292
Molecular FormulaC12H9ClN2O
Molecular Weight232.67 g/mol
Exact Mass232.04
IUPAC Name2-(4-chlorophenyl)pyridine-3-carboxamide
SMILESNC(=O)c1cccnc1-c1ccc(Cl)cc1
InChIInChI=1S/C12H9ClN2O/c13-9-5-3-8(4-6-9)11-10(12(14)16)2-1-7-15-11/h1-7H,(H2,14,16)
InChIKeyIYSOHERDRNKJAD-UHFFFAOYSA-N
XLogP2.50
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.67
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)pyridine-3-carbothioamide
CID 57370610
2-pyrimidin-2-ylpyridine-3-carboxamide
CID 154307272
methyl 2-(4-chlorophenyl)pyridine-3-carboxylate;propane
CID 170705123
2-(4-chlorophenyl)sulfanylpyridine-3-carboxamide
CID 725071
2-(4-chlorophenoxy)pyridine-3-carboxamide
CID 2774902
2-(3-pyridin-2-yl-2-pyridinyl)pyridine-3-carboxamide
CID 91031305
2-(4-chlorophenyl)-3-fluoropyridine
CID 66678603
bis[2-(4-methylphenyl)-3-pyridinyl]methanone
CID 67746009
2-chloropyridine-3-carboxamide;[4-(4-fluorophenoxy)phenyl]boronic acid;2-[4-(4-fluorophenoxy)phenyl]pyridine-3-carboxamide;methane
CID 157166699
2-[2-[4-(2-oxopropyl)phenyl]phenyl]pyridine-3-carboxamide
CID 174759952
CID 118468758
CID 118468758
2-(3-carboxy-4-chlorophenyl)pyridine-3-carboxylic acid
CID 53224258

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)pyridine-3-carboxamide?
The IUPAC name of 2-(4-chlorophenyl)pyridine-3-carboxamide (CID 140983292) is 2-(4-chlorophenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(4-chlorophenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(4-chlorophenyl)pyridine-3-carboxamide is NC(=O)c1cccnc1-c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)pyridine-3-carboxamide?
The InChIKey is IYSOHERDRNKJAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClN2O/c13-9-5-3-8(4-6-9)11-10(12(14)16)2-1-7-15-11/h1-7H,(H2,14,16).
What are the key properties of 2-(4-chlorophenyl)pyridine-3-carboxamide?
2-(4-chlorophenyl)pyridine-3-carboxamide has a molecular weight of 232.67 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)pyridine-3-carboxamide is sourced from PubChem (CID 140983292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).