2-(difluoromethyl)-5-iodopyridine-3-carboxamide

C7H5F2IN2O — CID 118837602

IUPAC2-(difluoromethyl)-5-iodopyridine-3-carboxamide
SMILESNC(=O)c1cc(I)cnc1C(F)F
InChIInChI=1S/C7H5F2IN2O/c8-6(9)5-4(7(11)13)1-3(10)2-12-5/h1-2,6H,(H2,11,13)
InChIKeyQATXILQRIHAAKE-UHFFFAOYSA-N
MW298.03 g/mol
LogP1.72
Rot. Bonds2

About 2-(difluoromethyl)-5-iodopyridine-3-carboxamide

2-(difluoromethyl)-5-iodopyridine-3-carboxamide (PubChem CID 118837602) has the molecular formula C7H5F2IN2O and a molecular weight of 298.03 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-iodopyridine-3-carboxamide.

Molecular Properties

Compound Name2-(difluoromethyl)-5-iodopyridine-3-carboxamide
PubChem CID118837602
Molecular FormulaC7H5F2IN2O
Molecular Weight298.03 g/mol
Exact Mass297.94
IUPAC Name2-(difluoromethyl)-5-iodopyridine-3-carboxamide
SMILESNC(=O)c1cc(I)cnc1C(F)F
InChIInChI=1S/C7H5F2IN2O/c8-6(9)5-4(7(11)13)1-3(10)2-12-5/h1-2,6H,(H2,11,13)
InChIKeyQATXILQRIHAAKE-UHFFFAOYSA-N
XLogP1.72
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.03
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-bromo-6-(difluoromethyl)-5-iodopyridine-3-carboxamide
CID 118806222
2-(difluoromethyl)-5-iodopyridin-3-amine
CID 130094620
2-(difluoromethyl)-5-hydroxy-6-iodopyridine-3-carboxamide
CID 118809374
6-(difluoromethyl)-5-iodo-4-methoxypyridine-3-carboxamide
CID 118854435
2-(difluoromethyl)-5-iodopyridine-3-carbaldehyde
CID 118820492
2-(difluoromethyl)-3-hydroxy-6-iodopyridine-4-carboxamide
CID 118837184
6-(difluoromethyl)-5-hydroxy-4-methylpyridine-3-carboxamide
CID 130084161
5,6-diamino-2-(difluoromethyl)pyridine-3-carboxamide
CID 119003054
2-(difluoromethyl)-3-iodo-6-methoxypyridine-4-carboxamide
CID 118837244
6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide
CID 130086462
2-(difluoromethyl)-3-iodo-5-nitropyridine-4-carboxamide
CID 118820528
(3R)-3-amino-3-(3-hydroxy-5-iodo-2-pyridinyl)propanoic acid
CID 131101628

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-iodopyridine-3-carboxamide?
The IUPAC name of 2-(difluoromethyl)-5-iodopyridine-3-carboxamide (CID 118837602) is 2-(difluoromethyl)-5-iodopyridine-3-carboxamide.
What is the SMILES notation for 2-(difluoromethyl)-5-iodopyridine-3-carboxamide?
The canonical SMILES for 2-(difluoromethyl)-5-iodopyridine-3-carboxamide is NC(=O)c1cc(I)cnc1C(F)F.
What is the InChIKey of 2-(difluoromethyl)-5-iodopyridine-3-carboxamide?
The InChIKey is QATXILQRIHAAKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F2IN2O/c8-6(9)5-4(7(11)13)1-3(10)2-12-5/h1-2,6H,(H2,11,13).
What are the key properties of 2-(difluoromethyl)-5-iodopyridine-3-carboxamide?
2-(difluoromethyl)-5-iodopyridine-3-carboxamide has a molecular weight of 298.03 g/mol, XLogP of 1.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-iodopyridine-3-carboxamide is sourced from PubChem (CID 118837602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).