4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide

C7H5F2IN2O2 — CID 118805994

IUPAC4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1[nH]c(=O)cc(C(F)F)c1I
InChIInChI=1S/C7H5F2IN2O2/c8-6(9)2-1-3(13)12-5(4(2)10)7(11)14/h1,6H,(H2,11,14)(H,12,13)
InChIKeyIPVQBNLWVWLQIP-UHFFFAOYSA-N
MW314.03 g/mol
LogP1.02
Rot. Bonds2

About 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide

4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide (PubChem CID 118805994) has the molecular formula C7H5F2IN2O2 and a molecular weight of 314.03 g/mol. Its IUPAC name is 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide.

Molecular Properties

Compound Name4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide
PubChem CID118805994
Molecular FormulaC7H5F2IN2O2
Molecular Weight314.03 g/mol
Exact Mass313.94
IUPAC Name4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide
SMILESNC(=O)c1[nH]c(=O)cc(C(F)F)c1I
InChIInChI=1S/C7H5F2IN2O2/c8-6(9)2-1-3(13)12-5(4(2)10)7(11)14/h1,6H,(H2,11,14)(H,12,13)
InChIKeyIPVQBNLWVWLQIP-UHFFFAOYSA-N
XLogP1.02
TPSA75.95 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.03
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 4-(difluoromethyl)-3-iodo-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

3-iodo-6-methyl-4-(trifluoromethyl)-1H-pyridin-2-one
CID 71552096
6-[6-oxo-4-(trifluoromethyl)-1H-pyridin-2-yl]-4-(trifluoromethyl)-1H-pyridin-2-one
CID 102133696
4-(Difluoromethyl)-6-hydroxy-5-iodopicolinamide
CID 118801169
2-(Difluoromethyl)-6-hydroxy-3-iodo-4-methylpyridine
CID 118803857
4-(Difluoromethyl)-6-hydroxypicolinamide
CID 118811925
4-(Difluoromethyl)-6-hydroxy-3-iodopicolinaldehyde
CID 118812846
2-(Aminomethyl)-4-(difluoromethyl)-6-hydroxy-3-iodopyridine
CID 118814453
2-(Difluoromethyl)-6-hydroxy-3-iodopyridine-4-carboxamide
CID 118815143
4-(Difluoromethyl)-3-fluoro-6-hydroxypicolinamide
CID 118817665
2-(Difluoromethyl)-6-hydroxy-4-iodo-3-methylpyridine
CID 118820557
4-(Difluoromethyl)-6-hydroxy-3-methylpicolinamide
CID 118823928
4-(Difluoromethyl)-6-hydroxy-5-iodopicolinaldehyde
CID 118829794

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide?
The IUPAC name of 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide (CID 118805994) is 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide.
What is the SMILES notation for 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide?
The canonical SMILES for 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide is NC(=O)c1[nH]c(=O)cc(C(F)F)c1I.
What is the InChIKey of 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide?
The InChIKey is IPVQBNLWVWLQIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F2IN2O2/c8-6(9)2-1-3(13)12-5(4(2)10)7(11)14/h1,6H,(H2,11,14)(H,12,13).
What are the key properties of 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide?
4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide has a molecular weight of 314.03 g/mol, XLogP of 1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-3-iodo-6-oxo-1H-pyridine-2-carboxamide is sourced from PubChem (CID 118805994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).