2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide

C18H14ClN3O2 — CID 46930319

IUPAC2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide
SMILESNc1ncccc1C(=O)Nc1cc(Cl)ccc1Oc1ccccc1
InChIInChI=1S/C18H14ClN3O2/c19-12-8-9-16(24-13-5-2-1-3-6-13)15(11-12)22-18(23)14-7-4-10-21-17(14)20/h1-11H,(H2,20,21)(H,22,23)
InChIKeyRRAMCIZUXAAMIB-UHFFFAOYSA-N
MW339.78 g/mol
LogP4.36
Rot. Bonds4

About 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide

2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide (PubChem CID 46930319) has the molecular formula C18H14ClN3O2 and a molecular weight of 339.78 g/mol. Its IUPAC name is 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide
PubChem CID46930319
Molecular FormulaC18H14ClN3O2
Molecular Weight339.78 g/mol
Exact Mass339.08
IUPAC Name2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide
SMILESNc1ncccc1C(=O)Nc1cc(Cl)ccc1Oc1ccccc1
InChIInChI=1S/C18H14ClN3O2/c19-12-8-9-16(24-13-5-2-1-3-6-13)15(11-12)22-18(23)14-7-4-10-21-17(14)20/h1-11H,(H2,20,21)(H,22,23)
InChIKeyRRAMCIZUXAAMIB-UHFFFAOYSA-N
XLogP4.36
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.78
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-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

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide?
The IUPAC name of 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide (CID 46930319) is 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide is Nc1ncccc1C(=O)Nc1cc(Cl)ccc1Oc1ccccc1.
What is the InChIKey of 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide?
The InChIKey is RRAMCIZUXAAMIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN3O2/c19-12-8-9-16(24-13-5-2-1-3-6-13)15(11-12)22-18(23)14-7-4-10-21-17(14)20/h1-11H,(H2,20,21)(H,22,23).
What are the key properties of 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide?
2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide has a molecular weight of 339.78 g/mol, XLogP of 4.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(5-chloro-2-phenoxyphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 46930319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).