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

C14H12Cl2IN3O — CID 107631458

IUPAC3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)Nc2ccc(Cl)cc2I)n1
InChIInChI=1S/C14H12Cl2IN3O/c1-2-18-12-6-4-9(16)13(20-12)14(21)19-11-5-3-8(15)7-10(11)17/h3-7H,2H2,1H3,(H,18,20)(H,19,21)
InChIKeyWMQJXOHNNOEVGK-UHFFFAOYSA-N
MW436.08 g/mol
LogP4.68
Rot. Bonds4

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

3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide (PubChem CID 107631458) has the molecular formula C14H12Cl2IN3O and a molecular weight of 436.08 g/mol. Its IUPAC name is 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide
PubChem CID107631458
Molecular FormulaC14H12Cl2IN3O
Molecular Weight436.08 g/mol
Exact Mass434.94
IUPAC Name3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide
SMILESCCNc1ccc(Cl)c(C(=O)Nc2ccc(Cl)cc2I)n1
InChIInChI=1S/C14H12Cl2IN3O/c1-2-18-12-6-4-9(16)13(20-12)14(21)19-11-5-3-8(15)7-10(11)17/h3-7H,2H2,1H3,(H,18,20)(H,19,21)
InChIKeyWMQJXOHNNOEVGK-UHFFFAOYSA-N
XLogP4.68
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.08
LogP ≤ 54.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-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

3-chloro-N-(5-chloro-2-methylphenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62185558
3-chloro-6-(ethylamino)-N-(2-iodophenyl)pyridine-2-carboxamide
CID 62167177
3-chloro-N-(2,5-difluorophenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62172239
3-chloro-N-(2-chloro-5-methylphenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 107631276
3-chloro-6-(ethylamino)-N-(4-fluoro-2-methylphenyl)pyridine-2-carboxamide
CID 62165196
3-chloro-6-(ethylamino)-N-(5-methyl-1,2-oxazol-3-yl)pyridine-2-carboxamide
CID 62165294
3-chloro-N-(2-iodophenyl)-6-(propylamino)pyridine-2-carboxamide
CID 62167329
3-chloro-6-(ethylamino)-N-(4-methylphenyl)pyridine-2-carboxamide
CID 62165390
N-(4-chloro-2-iodophenyl)-6-(propylamino)pyridine-2-carboxamide
CID 107631451
3-chloro-6-(ethylamino)-N-(2-methylpropyl)pyridine-2-carboxamide
CID 62170609
3-chloro-N-(3-cyanophenyl)-6-(ethylamino)pyridine-2-carboxamide
CID 62166201
N-(4-chloro-2-iodophenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 103766897

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide?
The IUPAC name of 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide (CID 107631458) is 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide is CCNc1ccc(Cl)c(C(=O)Nc2ccc(Cl)cc2I)n1.
What is the InChIKey of 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide?
The InChIKey is WMQJXOHNNOEVGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2IN3O/c1-2-18-12-6-4-9(16)13(20-12)14(21)19-11-5-3-8(15)7-10(11)17/h3-7H,2H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide?
3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide has a molecular weight of 436.08 g/mol, XLogP of 4.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(4-chloro-2-iodophenyl)-6-(ethylamino)pyridine-2-carboxamide is sourced from PubChem (CID 107631458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).