4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide

C15H15ClN2O2 — CID 81227385

IUPAC4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
SMILESCOc1c(C)ccc(NC(=O)c2cnccc2Cl)c1C
InChIInChI=1S/C15H15ClN2O2/c1-9-4-5-13(10(2)14(9)20-3)18-15(19)11-8-17-7-6-12(11)16/h4-8H,1-3H3,(H,18,19)
InChIKeyGMBJYZHKRUTLPN-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.61
Rot. Bonds3

About 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide

4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide (PubChem CID 81227385) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
PubChem CID81227385
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
SMILESCOc1c(C)ccc(NC(=O)c2cnccc2Cl)c1C
InChIInChI=1S/C15H15ClN2O2/c1-9-4-5-13(10(2)14(9)20-3)18-15(19)11-8-17-7-6-12(11)16/h4-8H,1-3H3,(H,18,19)
InChIKeyGMBJYZHKRUTLPN-UHFFFAOYSA-N
XLogP3.61
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyrazine-2-carboxamide
CID 107246554
2-amino-4-chloro-N-(3-methoxy-2,4-dimethylphenyl)benzamide
CID 63110657
2,3-difluoro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-4-carboxamide
CID 105380636
4-chloro-N-(4-methoxy-3-methylphenyl)pyridine-3-carboxamide
CID 81227052
4-[(4-chloropyridine-3-carbonyl)amino]-3-methylbenzoic acid
CID 81226642
5-hydroxy-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
CID 63860127
4-chloro-N-(3-hydroxy-4-methylphenyl)pyridine-3-carboxamide
CID 107701234
2-fluoro-N-(3-methoxy-2,4-dimethylphenyl)-5-methylbenzamide
CID 62509266
4-chloro-N-methoxypyridine-3-carboxamide
CID 103871256
3-chloro-N-(2,3-dimethylphenyl)pyridine-4-carboxamide
CID 66462249
6-bromo-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide
CID 66462513
N-(3-methoxy-2,4-dimethylphenyl)prop-2-enamide
CID 43696159

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide (CID 81227385) is 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide is COc1c(C)ccc(NC(=O)c2cnccc2Cl)c1C.
What is the InChIKey of 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide?
The InChIKey is GMBJYZHKRUTLPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-9-4-5-13(10(2)14(9)20-3)18-15(19)11-8-17-7-6-12(11)16/h4-8H,1-3H3,(H,18,19).
What are the key properties of 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide?
4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide has a molecular weight of 290.75 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(3-methoxy-2,4-dimethylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 81227385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).