5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide

C7H6F2IN3O — CID 130105795

IUPAC5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide
SMILESNC(=O)c1ncc(N)c(C(F)F)c1I
InChIInChI=1S/C7H6F2IN3O/c8-6(9)3-2(11)1-13-5(4(3)10)7(12)14/h1,6H,11H2,(H2,12,14)
InChIKeyFWAMDXASTXPGIH-UHFFFAOYSA-N
MW313.05 g/mol
LogP1.30
Rot. Bonds2

About 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide

5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide (PubChem CID 130105795) has the molecular formula C7H6F2IN3O and a molecular weight of 313.05 g/mol. Its IUPAC name is 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide
PubChem CID130105795
Molecular FormulaC7H6F2IN3O
Molecular Weight313.05 g/mol
Exact Mass312.95
IUPAC Name5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide
SMILESNC(=O)c1ncc(N)c(C(F)F)c1I
InChIInChI=1S/C7H6F2IN3O/c8-6(9)3-2(11)1-13-5(4(3)10)7(12)14/h1,6H,11H2,(H2,12,14)
InChIKeyFWAMDXASTXPGIH-UHFFFAOYSA-N
XLogP1.30
TPSA82.00 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.05
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-bromo-4-(difluoromethyl)-3-iodopyridine-2-carboxamide
CID 130068606
4-(difluoromethyl)-3-iodo-5-methoxypyridine-2-carboxamide
CID 118835097
3-(difluoromethyl)-4,5-diiodopyridine-2-carboxamide
CID 130100754
4-(difluoromethyl)-5,6-diiodopyridin-3-amine
CID 130100391
3-amino-5-chloro-4-(difluoromethyl)pyridine-2-carboxamide
CID 130103158
5-amino-4-(difluoromethyl)-3-hydroxypyridine-2-carbonyl chloride
CID 130105021
3-(difluoromethyl)-4,5-difluoropyridine-2-carboxamide
CID 118807178
3-(difluoromethyl)-2,5-diiodopyridine-4-carboxamide
CID 130100748
methyl 5-amino-4-(difluoromethyl)-3-methoxypyridine-2-carboxylate
CID 134671357
5-(difluoromethyl)-6-fluoro-4-iodopyridin-3-amine
CID 130103870
5-(aminomethyl)-4-(difluoromethyl)-6-iodopyridin-3-amine
CID 130105277
4-amino-5-(difluoromethyl)-3-fluoropyridine-2-carboxamide
CID 118816543

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide?
The IUPAC name of 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide (CID 130105795) is 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide.
What is the SMILES notation for 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide?
The canonical SMILES for 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide is NC(=O)c1ncc(N)c(C(F)F)c1I.
What is the InChIKey of 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide?
The InChIKey is FWAMDXASTXPGIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2IN3O/c8-6(9)3-2(11)1-13-5(4(3)10)7(12)14/h1,6H,11H2,(H2,12,14).
What are the key properties of 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide?
5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide has a molecular weight of 313.05 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-(difluoromethyl)-3-iodopyridine-2-carboxamide is sourced from PubChem (CID 130105795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).