3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide

C16H13N3O2 — CID 81440113

IUPAC3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide
SMILESCc1ccc2cccc(NC(=O)c3ccncc3O)c2n1
InChIInChI=1S/C16H13N3O2/c1-10-5-6-11-3-2-4-13(15(11)18-10)19-16(21)12-7-8-17-9-14(12)20/h2-9,20H,1H3,(H,19,21)
InChIKeyYEWYKQCQUCQUDH-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.90
Rot. Bonds2

About 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide

3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide (PubChem CID 81440113) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide
PubChem CID81440113
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC Name3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide
SMILESCc1ccc2cccc(NC(=O)c3ccncc3O)c2n1
InChIInChI=1S/C16H13N3O2/c1-10-5-6-11-3-2-4-13(15(11)18-10)19-16(21)12-7-8-17-9-14(12)20/h2-9,20H,1H3,(H,19,21)
InChIKeyYEWYKQCQUCQUDH-UHFFFAOYSA-N
XLogP2.90
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-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 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide?
The IUPAC name of 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide (CID 81440113) is 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide?
The canonical SMILES for 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide is Cc1ccc2cccc(NC(=O)c3ccncc3O)c2n1.
What is the InChIKey of 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide?
The InChIKey is YEWYKQCQUCQUDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c1-10-5-6-11-3-2-4-13(15(11)18-10)19-16(21)12-7-8-17-9-14(12)20/h2-9,20H,1H3,(H,19,21).
What are the key properties of 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide?
3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide has a molecular weight of 279.30 g/mol, XLogP of 2.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(2-methylquinolin-8-yl)pyridine-4-carboxamide is sourced from PubChem (CID 81440113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).