4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide

C14H12ClFN2O2 — CID 81227053

IUPAC4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide
SMILESCOc1cc(F)ccc1NC(=O)c1cnc(C)cc1Cl
InChIInChI=1S/C14H12ClFN2O2/c1-8-5-11(15)10(7-17-8)14(19)18-12-4-3-9(16)6-13(12)20-2/h3-7H,1-2H3,(H,18,19)
InChIKeyRNTHWEGZMCHNEF-UHFFFAOYSA-N
MW294.71 g/mol
LogP3.44
Rot. Bonds3

About 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide

4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide (PubChem CID 81227053) has the molecular formula C14H12ClFN2O2 and a molecular weight of 294.71 g/mol. Its IUPAC name is 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide
PubChem CID81227053
Molecular FormulaC14H12ClFN2O2
Molecular Weight294.71 g/mol
Exact Mass294.06
IUPAC Name4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide
SMILESCOc1cc(F)ccc1NC(=O)c1cnc(C)cc1Cl
InChIInChI=1S/C14H12ClFN2O2/c1-8-5-11(15)10(7-17-8)14(19)18-12-4-3-9(16)6-13(12)20-2/h3-7H,1-2H3,(H,18,19)
InChIKeyRNTHWEGZMCHNEF-UHFFFAOYSA-N
XLogP3.44
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.71
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dichloro-N-(4-fluoro-2-methoxyphenyl)pyridine-4-carboxamide
CID 114918264
5-chloro-N-(4-fluoro-2-methoxyphenyl)-6-(methylamino)pyridine-3-carboxamide
CID 62175694
5-amino-N-(4-fluoro-2-methoxyphenyl)pyridine-2-carboxamide
CID 81317431
2-bromo-4-chloro-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 103763825
2-amino-4-fluoro-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 63110567
3-fluoro-N-(4-fluoro-2-methoxyphenyl)-2-hydrazinylpyridine-4-carboxamide
CID 105388058
5-(aminomethyl)-N-(4-fluoro-2-methoxyphenyl)pyridine-2-carboxamide
CID 63724738
4-chloro-N-[(2,5-difluorophenyl)methyl]-6-methylpyridine-3-carboxamide
CID 81227233
3-amino-2-chloro-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 115930471
4-chloro-N-(3-fluoro-5-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81232937
4-[(4-fluoro-2-methylbenzoyl)amino]-3-methoxybenzoic acid
CID 137374056
4-chloro-N-(3,5-dichloro-4-fluorophenyl)-6-methylpyridine-3-carboxamide
CID 106509693

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide (CID 81227053) is 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide is COc1cc(F)ccc1NC(=O)c1cnc(C)cc1Cl.
What is the InChIKey of 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is RNTHWEGZMCHNEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClFN2O2/c1-8-5-11(15)10(7-17-8)14(19)18-12-4-3-9(16)6-13(12)20-2/h3-7H,1-2H3,(H,18,19).
What are the key properties of 4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide?
4-chloro-N-(4-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide has a molecular weight of 294.71 g/mol, XLogP of 3.44, 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-fluoro-2-methoxyphenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81227053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).