4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide

C8H8F2N2O2 — CID 137377141

IUPAC4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide
SMILESCn1cc(C(N)=O)c(C(F)F)cc1=O
InChIInChI=1S/C8H8F2N2O2/c1-12-3-5(8(11)14)4(7(9)10)2-6(12)13/h2-3,7H,1H3,(H2,11,14)
InChIKeyZSGSBYQVLCBFGI-UHFFFAOYSA-N
MW202.16 g/mol
LogP0.42
Rot. Bonds2

About 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide

4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide (PubChem CID 137377141) has the molecular formula C8H8F2N2O2 and a molecular weight of 202.16 g/mol. Its IUPAC name is 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide
PubChem CID137377141
Molecular FormulaC8H8F2N2O2
Molecular Weight202.16 g/mol
Exact Mass202.06
IUPAC Name4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide
SMILESCn1cc(C(N)=O)c(C(F)F)cc1=O
InChIInChI=1S/C8H8F2N2O2/c1-12-3-5(8(11)14)4(7(9)10)2-6(12)13/h2-3,7H,1H3,(H2,11,14)
InChIKeyZSGSBYQVLCBFGI-UHFFFAOYSA-N
XLogP0.42
TPSA65.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.16
LogP ≤ 50.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide?
The IUPAC name of 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide (CID 137377141) is 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide is Cn1cc(C(N)=O)c(C(F)F)cc1=O.
What is the InChIKey of 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide?
The InChIKey is ZSGSBYQVLCBFGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2O2/c1-12-3-5(8(11)14)4(7(9)10)2-6(12)13/h2-3,7H,1H3,(H2,11,14).
What are the key properties of 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide?
4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide has a molecular weight of 202.16 g/mol, XLogP of 0.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-1-methyl-6-oxopyridine-3-carboxamide is sourced from PubChem (CID 137377141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).