6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

C16H22N2O3 — CID 51055039

IUPAC6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESCC1CCc2[nH]c(=O)c(C(=O)NCC3CCCO3)cc2C1
InChIInChI=1S/C16H22N2O3/c1-10-4-5-14-11(7-10)8-13(16(20)18-14)15(19)17-9-12-3-2-6-21-12/h8,10,12H,2-7,9H2,1H3,(H,17,19)(H,18,20)
InChIKeyJWLJBHANPLZPTK-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.41
Rot. Bonds3

About 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (PubChem CID 51055039) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
PubChem CID51055039
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESCC1CCc2[nH]c(=O)c(C(=O)NCC3CCCO3)cc2C1
InChIInChI=1S/C16H22N2O3/c1-10-4-5-14-11(7-10)8-13(16(20)18-14)15(19)17-9-12-3-2-6-21-12/h8,10,12H,2-7,9H2,1H3,(H,17,19)(H,18,20)
InChIKeyJWLJBHANPLZPTK-UHFFFAOYSA-N
XLogP1.41
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-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 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The IUPAC name of 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (CID 51055039) is 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.
What is the SMILES notation for 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The canonical SMILES for 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is CC1CCc2[nH]c(=O)c(C(=O)NCC3CCCO3)cc2C1.
What is the InChIKey of 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The InChIKey is JWLJBHANPLZPTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-10-4-5-14-11(7-10)8-13(16(20)18-14)15(19)17-9-12-3-2-6-21-12/h8,10,12H,2-7,9H2,1H3,(H,17,19)(H,18,20).
What are the key properties of 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide has a molecular weight of 290.36 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-oxo-N-(oxolan-2-ylmethyl)-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is sourced from PubChem (CID 51055039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).