4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide

C13H11FIN3O — CID 81245036

IUPAC4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)Nc2ccc(F)cc2I)cn1
InChIInChI=1S/C13H11FIN3O/c1-7-4-11(16)9(6-17-7)13(19)18-12-3-2-8(14)5-10(12)15/h2-6H,1H3,(H2,16,17)(H,18,19)
InChIKeyGJDDKQPRMHEGOK-UHFFFAOYSA-N
MW371.15 g/mol
LogP2.97
Rot. Bonds2

About 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide

4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide (PubChem CID 81245036) has the molecular formula C13H11FIN3O and a molecular weight of 371.15 g/mol. Its IUPAC name is 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide
PubChem CID81245036
Molecular FormulaC13H11FIN3O
Molecular Weight371.15 g/mol
Exact Mass370.99
IUPAC Name4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide
SMILESCc1cc(N)c(C(=O)Nc2ccc(F)cc2I)cn1
InChIInChI=1S/C13H11FIN3O/c1-7-4-11(16)9(6-17-7)13(19)18-12-3-2-8(14)5-10(12)15/h2-6H,1H3,(H2,16,17)(H,18,19)
InChIKeyGJDDKQPRMHEGOK-UHFFFAOYSA-N
XLogP2.97
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.15
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-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

4-amino-6-methyl-N-(2,4,5-trifluorophenyl)pyridine-3-carboxamide
CID 81240870
2,4-diamino-N-(4-fluoro-2-iodophenyl)benzamide
CID 79768786
4-amino-N-(3-fluoro-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81242532
2-amino-3-fluoro-N-(4-fluoro-2-iodophenyl)pyridine-4-carboxamide
CID 105386874
4-amino-N-(4-methoxy-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81240718
4-amino-N-(2-fluoro-5-nitrophenyl)-6-methylpyridine-3-carboxamide
CID 81238388
5-amino-N-(4-fluoro-2-iodophenyl)pyridine-2-carboxamide
CID 81316083
4-amino-N-(5-chloro-2-methylphenyl)-6-methylpyridine-3-carboxamide
CID 81233570
4-amino-N-(3-iodophenyl)-6-methylpyridine-3-carboxamide
CID 81236350
4-amino-6-methyl-N-phenylpyridine-3-carboxamide
CID 81236063
4-amino-N-[(2,4-difluorophenyl)methyl]-6-methylpyridine-3-carboxamide
CID 81239765
2-amino-N-(4-fluoro-2-iodophenyl)-5-methoxybenzamide
CID 79769439

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide?
The IUPAC name of 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide (CID 81245036) is 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide?
The canonical SMILES for 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide is Cc1cc(N)c(C(=O)Nc2ccc(F)cc2I)cn1.
What is the InChIKey of 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide?
The InChIKey is GJDDKQPRMHEGOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FIN3O/c1-7-4-11(16)9(6-17-7)13(19)18-12-3-2-8(14)5-10(12)15/h2-6H,1H3,(H2,16,17)(H,18,19).
What are the key properties of 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide?
4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide has a molecular weight of 371.15 g/mol, XLogP of 2.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-fluoro-2-iodophenyl)-6-methylpyridine-3-carboxamide is sourced from PubChem (CID 81245036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).