3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide

C14H13ClN2O — CID 66462437

IUPAC3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1ccncc1Cl
InChIInChI=1S/C14H13ClN2O/c1-2-10-5-3-4-6-13(10)17-14(18)11-7-8-16-9-12(11)15/h3-9H,2H2,1H3,(H,17,18)
InChIKeyPBOWMFLEWHLEOH-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.55
Rot. Bonds3

About 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide

3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide (PubChem CID 66462437) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide
PubChem CID66462437
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC Name3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide
SMILESCCc1ccccc1NC(=O)c1ccncc1Cl
InChIInChI=1S/C14H13ClN2O/c1-2-10-5-3-4-6-13(10)17-14(18)11-7-8-16-9-12(11)15/h3-9H,2H2,1H3,(H,17,18)
InChIKeyPBOWMFLEWHLEOH-UHFFFAOYSA-N
XLogP3.55
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-chloro-N-(2-propylphenyl)pyridine-4-carboxamide
CID 66482935
3-chloro-N-(2-hydroxyphenyl)pyridine-4-carboxamide
CID 103715642
3-chloro-N-(2,3-dimethylphenyl)pyridine-4-carboxamide
CID 66462249
3-chloro-N-[2-(5-ethyltetrazol-1-yl)phenyl]pyridine-4-carboxamide
CID 122143190
1-N,2-N-bis(2-ethylphenyl)benzene-1,2-dicarboxamide
CID 4151337
3-chloro-N-(3-fluoro-2-methylphenyl)pyridine-4-carboxamide
CID 66484528
3-chloro-N-[2-(dimethylamino)-3-pyridinyl]pyridine-4-carboxamide
CID 66482742
3-chloro-N-[2-(N'-hydroxycarbamimidoyl)phenyl]pyridine-4-carboxamide
CID 77135119
3-chloro-N-(2-methoxy-3-pyridinyl)pyridine-4-carboxamide
CID 66484881
3-chloro-N-[(2-hydroxyphenyl)methyl]pyridine-4-carboxamide
CID 115667770
3-chloro-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide
CID 66482984
N-(2-chlorophenyl)-3-hydroxypyridine-4-carboxamide
CID 81443413

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide?
The IUPAC name of 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide (CID 66462437) is 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide is CCc1ccccc1NC(=O)c1ccncc1Cl.
What is the InChIKey of 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide?
The InChIKey is PBOWMFLEWHLEOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c1-2-10-5-3-4-6-13(10)17-14(18)11-7-8-16-9-12(11)15/h3-9H,2H2,1H3,(H,17,18).
What are the key properties of 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide?
3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide has a molecular weight of 260.72 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2-ethylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 66462437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).