3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide

C7H5ClF2N2O2 — CID 130072951

IUPAC3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1[nH]c(=O)c(C(F)F)cc1Cl
InChIInChI=1S/C7H5ClF2N2O2/c8-3-1-2(5(9)10)7(14)12-4(3)6(11)13/h1,5H,(H2,11,13)(H,12,14)
InChIKeyISUIFQNSSCVPGL-UHFFFAOYSA-N
MW222.58 g/mol
LogP1.06
Rot. Bonds2

About 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide

3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 130072951) has the molecular formula C7H5ClF2N2O2 and a molecular weight of 222.58 g/mol. Its IUPAC name is 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide
PubChem CID130072951
Molecular FormulaC7H5ClF2N2O2
Molecular Weight222.58 g/mol
Exact Mass222.00
IUPAC Name3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1[nH]c(=O)c(C(F)F)cc1Cl
InChIInChI=1S/C7H5ClF2N2O2/c8-3-1-2(5(9)10)7(14)12-4(3)6(11)13/h1,5H,(H2,11,13)(H,12,14)
InChIKeyISUIFQNSSCVPGL-UHFFFAOYSA-N
XLogP1.06
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.58
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

5-(difluoromethyl)-3-methyl-6-oxo-1H-pyridine-2-carbonyl chloride
CID 130084060
3-bromo-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxylic acid
CID 130110439
5-chloro-3-(difluoromethyl)-6-fluoropyridine-2-carboxamide
CID 130072214
4-(difluoromethyl)-5-iodo-6-oxo-1H-pyridine-2-carboxamide
CID 118801169
2-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-3-sulfonamide
CID 118998534
2-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-3-carbaldehyde
CID 119023480
6-chloro-4-(difluoromethyl)-2-oxo-1H-pyridine-3-sulfonamide
CID 130072899
5-(difluoromethyl)-2-fluoro-6-oxo-1H-pyridine-3-carboxylic acid
CID 130079672
5-amino-3-(difluoromethyl)-6-(hydroxymethyl)-1H-pyridin-2-one
CID 130104849
3-(difluoromethyl)-5-fluoro-6-methoxy-1H-pyridin-2-one
CID 130079270
3-(difluoromethyl)-6-fluoro-4-oxo-1H-pyridine-2-carboxamide
CID 130079843
3-(difluoromethyl)-5-methyl-6-oxo-1H-pyridine-2-carboxylic acid
CID 130083953

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide (CID 130072951) is 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide is NC(=O)c1[nH]c(=O)c(C(F)F)cc1Cl.
What is the InChIKey of 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is ISUIFQNSSCVPGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5ClF2N2O2/c8-3-1-2(5(9)10)7(14)12-4(3)6(11)13/h1,5H,(H2,11,13)(H,12,14).
What are the key properties of 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide?
3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 222.58 g/mol, XLogP of 1.06, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-(difluoromethyl)-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 130072951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).