2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide

C20H19N3O3 — CID 167981378

IUPAC2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide
SMILESCn1c2c(ccc1=O)C(NC(=O)c1ccnc(-c3ccco3)c1)CCC2
InChIInChI=1S/C20H19N3O3/c1-23-17-5-2-4-15(14(17)7-8-19(23)24)22-20(25)13-9-10-21-16(12-13)18-6-3-11-26-18/h3,6-12,15H,2,4-5H2,1H3,(H,22,25)
InChIKeySWPMQHLNQLUBKH-UHFFFAOYSA-N
MW349.39 g/mol
LogP2.85
Rot. Bonds3

About 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide

2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide (PubChem CID 167981378) has the molecular formula C20H19N3O3 and a molecular weight of 349.39 g/mol. Its IUPAC name is 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide
PubChem CID167981378
Molecular FormulaC20H19N3O3
Molecular Weight349.39 g/mol
Exact Mass349.14
IUPAC Name2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide
SMILESCn1c2c(ccc1=O)C(NC(=O)c1ccnc(-c3ccco3)c1)CCC2
InChIInChI=1S/C20H19N3O3/c1-23-17-5-2-4-15(14(17)7-8-19(23)24)22-20(25)13-9-10-21-16(12-13)18-6-3-11-26-18/h3,6-12,15H,2,4-5H2,1H3,(H,22,25)
InChIKeySWPMQHLNQLUBKH-UHFFFAOYSA-N
XLogP2.85
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.39
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-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 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide?
The IUPAC name of 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide (CID 167981378) is 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide is Cn1c2c(ccc1=O)C(NC(=O)c1ccnc(-c3ccco3)c1)CCC2.
What is the InChIKey of 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide?
The InChIKey is SWPMQHLNQLUBKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O3/c1-23-17-5-2-4-15(14(17)7-8-19(23)24)22-20(25)13-9-10-21-16(12-13)18-6-3-11-26-18/h3,6-12,15H,2,4-5H2,1H3,(H,22,25).
What are the key properties of 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide?
2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide has a molecular weight of 349.39 g/mol, XLogP of 2.85, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-yl)-N-(1-methyl-2-oxo-5,6,7,8-tetrahydroquinolin-5-yl)pyridine-4-carboxamide is sourced from PubChem (CID 167981378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).