2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide

C12H9ClIN3O — CID 62154226

IUPAC2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2cccc(I)c2)cc(Cl)n1
InChIInChI=1S/C12H9ClIN3O/c13-10-4-7(5-11(15)17-10)12(18)16-9-3-1-2-8(14)6-9/h1-6H,(H2,15,17)(H,16,18)
InChIKeyOVUPZUUZEMGLOT-UHFFFAOYSA-N
MW373.58 g/mol
LogP3.17
Rot. Bonds2

About 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide

2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide (PubChem CID 62154226) has the molecular formula C12H9ClIN3O and a molecular weight of 373.58 g/mol. Its IUPAC name is 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide
PubChem CID62154226
Molecular FormulaC12H9ClIN3O
Molecular Weight373.58 g/mol
Exact Mass372.95
IUPAC Name2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2cccc(I)c2)cc(Cl)n1
InChIInChI=1S/C12H9ClIN3O/c13-10-4-7(5-11(15)17-10)12(18)16-9-3-1-2-8(14)6-9/h1-6H,(H2,15,17)(H,16,18)
InChIKeyOVUPZUUZEMGLOT-UHFFFAOYSA-N
XLogP3.17
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.58
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

3,5-diamino-N-(3-iodophenyl)benzamide
CID 61095528
2-amino-6-chloro-N-(2-iodophenyl)pyridine-4-carboxamide
CID 62154227
2-amino-6-chloro-N-(4-methylphenyl)pyridine-4-carboxamide
CID 62156439
6-chloro-N-(3-iodophenyl)pyridine-2-carboxamide
CID 55052347
2-amino-N-(3-bromo-4-methylphenyl)-6-chloropyridine-4-carboxamide
CID 62871680
6-chloro-N-(3-iodophenyl)pyrazine-2-carboxamide
CID 103336801
2-amino-6-chloro-N-(2,6-diethylphenyl)pyridine-4-carboxamide
CID 62153038
3-[(2,6-dichloropyridine-4-carbonyl)amino]benzoic acid
CID 60657143
2-amino-6-chloro-N-(1,2-thiazol-4-yl)pyridine-4-carboxamide
CID 154842220
5-benzamido-1-N,3-N-bis(3-iodophenyl)benzene-1,3-dicarboxamide
CID 3501081
2-amino-3-chloro-N-(3-iodophenyl)benzamide
CID 113331655
2-amino-N-(2-bromo-5-chlorophenyl)-6-chloropyridine-4-carboxamide
CID 81275531

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide (CID 62154226) is 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide is Nc1cc(C(=O)Nc2cccc(I)c2)cc(Cl)n1.
What is the InChIKey of 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide?
The InChIKey is OVUPZUUZEMGLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9ClIN3O/c13-10-4-7(5-11(15)17-10)12(18)16-9-3-1-2-8(14)6-9/h1-6H,(H2,15,17)(H,16,18).
What are the key properties of 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide?
2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide has a molecular weight of 373.58 g/mol, XLogP of 3.17, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-(3-iodophenyl)pyridine-4-carboxamide is sourced from PubChem (CID 62154226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).