4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide

C14H13ClN2O2 — CID 81227052

IUPAC4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cnccc2Cl)cc1C
InChIInChI=1S/C14H13ClN2O2/c1-9-7-10(3-4-13(9)19-2)17-14(18)11-8-16-6-5-12(11)15/h3-8H,1-2H3,(H,17,18)
InChIKeyNISCKXLFUKYQIM-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.30
Rot. Bonds3

About 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide

4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide (PubChem CID 81227052) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide
PubChem CID81227052
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC Name4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cnccc2Cl)cc1C
InChIInChI=1S/C14H13ClN2O2/c1-9-7-10(3-4-13(9)19-2)17-14(18)11-8-16-6-5-12(11)15/h3-8H,1-2H3,(H,17,18)
InChIKeyNISCKXLFUKYQIM-UHFFFAOYSA-N
XLogP3.30
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
CID 107701234
2-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide
CID 61072257
4-chloro-N-(3-chloro-4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 81230238
5-chloro-2-fluoro-N-(4-methoxy-3-methylphenyl)benzamide
CID 61073474
4-chloro-N-(2-methoxy-4-pyridinyl)pyridine-3-carboxamide
CID 112739518
5-chloro-2-hydroxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 47317877
N-(4-chloro-3-methoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 99842680
3-chloro-N-[3-(dimethylcarbamoyl)-4-methoxyphenyl]pyridine-4-carboxamide
CID 131944597
5-hydrazinyl-N-(4-methoxy-3-methylphenyl)pyridine-2-carboxamide
CID 104642300
N-(4-methoxy-3-methylphenyl)-1,2,5-thiadiazole-3-carboxamide
CID 87032400
2-hydroxy-N-(4-methoxy-3-methylphenyl)-4-methylbenzamide
CID 47317808
2,6-dimethoxy-N-(4-methoxy-3-methylphenyl)benzamide
CID 110776411

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide (CID 81227052) is 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide is COc1ccc(NC(=O)c2cnccc2Cl)cc1C.
What is the InChIKey of 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide?
The InChIKey is NISCKXLFUKYQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-9-7-10(3-4-13(9)19-2)17-14(18)11-8-16-6-5-12(11)15/h3-8H,1-2H3,(H,17,18).
What are the key properties of 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide?
4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide has a molecular weight of 276.72 g/mol, XLogP of 3.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 81227052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).