6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide

C8H7F2IN2O — CID 130086462

IUPAC6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide
SMILESCc1cc(I)c(C(N)=O)nc1C(F)F
InChIInChI=1S/C8H7F2IN2O/c1-3-2-4(11)6(8(12)14)13-5(3)7(9)10/h2,7H,1H3,(H2,12,14)
InChIKeyQNRXEHPYCLMDSW-UHFFFAOYSA-N
MW312.06 g/mol
LogP2.03
Rot. Bonds2

About 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide

6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide (PubChem CID 130086462) has the molecular formula C8H7F2IN2O and a molecular weight of 312.06 g/mol. Its IUPAC name is 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide
PubChem CID130086462
Molecular FormulaC8H7F2IN2O
Molecular Weight312.06 g/mol
Exact Mass311.96
IUPAC Name6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide
SMILESCc1cc(I)c(C(N)=O)nc1C(F)F
InChIInChI=1S/C8H7F2IN2O/c1-3-2-4(11)6(8(12)14)13-5(3)7(9)10/h2,7H,1H3,(H2,12,14)
InChIKeyQNRXEHPYCLMDSW-UHFFFAOYSA-N
XLogP2.03
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.06
LogP ≤ 52.03
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

6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxylic acid
CID 118809209
methyl 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxylate
CID 130086271
5-amino-6-(difluoromethyl)-3-methylpyridine-2-carboxamide
CID 130106784
6-(difluoromethyl)-2-fluoro-5-methylpyridine-3-carboxamide
CID 118814860
2-[6-(difluoromethyl)-3-iodo-5-methyl-2-pyridinyl]acetic acid
CID 118848636
6-(difluoromethyl)-2-iodo-5-methylpyridine-3-carboxylic acid
CID 118815145
2-(difluoromethyl)-5-hydroxy-6-iodopyridine-3-carboxamide
CID 118809374
ethyl 5-chloro-6-(difluoromethyl)-3-iodopyridine-2-carboxylate
CID 134677140
6-(difluoromethyl)-5-hydroxy-2-methylpyridine-3-carboxamide
CID 118837404
6-amino-3-(difluoromethyl)-4-methylpyridine-2-carboxamide
CID 130106776
2-(difluoromethyl)-4,6-dimethylpyridine-3-carboxamide
CID 130101522
6-(difluoromethyl)-3,4-dimethylpyridine-2-carboxamide
CID 130101536

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide?
The IUPAC name of 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide (CID 130086462) is 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide.
What is the SMILES notation for 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide?
The canonical SMILES for 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide is Cc1cc(I)c(C(N)=O)nc1C(F)F.
What is the InChIKey of 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide?
The InChIKey is QNRXEHPYCLMDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F2IN2O/c1-3-2-4(11)6(8(12)14)13-5(3)7(9)10/h2,7H,1H3,(H2,12,14).
What are the key properties of 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide?
6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide has a molecular weight of 312.06 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-3-iodo-5-methylpyridine-2-carboxamide is sourced from PubChem (CID 130086462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).