2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide

C9H10F2N2O3 — CID 118837482

IUPAC2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide
SMILESCOc1cnc(C(F)F)c(OC)c1C(N)=O
InChIInChI=1S/C9H10F2N2O3/c1-15-4-3-13-6(8(10)11)7(16-2)5(4)9(12)14/h3,8H,1-2H3,(H2,12,14)
InChIKeyBVJCFCDNMZPSSI-UHFFFAOYSA-N
MW232.19 g/mol
LogP1.14
Rot. Bonds4

About 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide

2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide (PubChem CID 118837482) has the molecular formula C9H10F2N2O3 and a molecular weight of 232.19 g/mol. Its IUPAC name is 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide.

Molecular Properties

Compound Name2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide
PubChem CID118837482
Molecular FormulaC9H10F2N2O3
Molecular Weight232.19 g/mol
Exact Mass232.07
IUPAC Name2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide
SMILESCOc1cnc(C(F)F)c(OC)c1C(N)=O
InChIInChI=1S/C9H10F2N2O3/c1-15-4-3-13-6(8(10)11)7(16-2)5(4)9(12)14/h3,8H,1-2H3,(H2,12,14)
InChIKeyBVJCFCDNMZPSSI-UHFFFAOYSA-N
XLogP1.14
TPSA74.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.19
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carboxamide
CID 118809416
2-(difluoromethyl)-4,5-dimethoxypyridine-3-carboxylic acid
CID 130100978
methyl 2-(difluoromethyl)-5-fluoro-3-methoxypyridine-4-carboxylate
CID 133105622
6-(difluoromethyl)-5-iodo-4-methoxypyridine-3-carboxamide
CID 118854435
ethyl 2-(difluoromethyl)-5-fluoro-3-methoxypyridine-4-carboxylate
CID 133105363
methyl 3-chloro-2-(difluoromethyl)-5-methoxypyridine-4-carboxylate
CID 134674417
ethyl 2-(difluoromethyl)-4-iodo-5-methoxypyridine-3-carboxylate
CID 133101504
ethyl 4-chloro-2-(difluoromethyl)-5-methoxypyridine-3-carboxylate
CID 134684705
2-(difluoromethyl)-4,6-dimethoxypyridine-3-carboxamide
CID 118809246
2-(difluoromethyl)-5-methoxy-4-methylpyridine-3-carbonyl chloride
CID 118832244
2-bromo-5-(difluoromethyl)-4-methoxypyridine-3-carboxamide
CID 119011099
ethyl 2-(difluoromethyl)-4-methoxy-5-methylpyridine-3-carboxylate
CID 133100499

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide?
The IUPAC name of 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide (CID 118837482) is 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide.
What is the SMILES notation for 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide?
The canonical SMILES for 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide is COc1cnc(C(F)F)c(OC)c1C(N)=O.
What is the InChIKey of 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide?
The InChIKey is BVJCFCDNMZPSSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2N2O3/c1-15-4-3-13-6(8(10)11)7(16-2)5(4)9(12)14/h3,8H,1-2H3,(H2,12,14).
What are the key properties of 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide?
2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide has a molecular weight of 232.19 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-3,5-dimethoxypyridine-4-carboxamide is sourced from PubChem (CID 118837482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).