3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide

C17H20N4O — CID 91392290

IUPAC3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide
SMILESCCCC(CC(N)=O)n1c(C)nc2cnc3ccccc3c21
InChIInChI=1S/C17H20N4O/c1-3-6-12(9-16(18)22)21-11(2)20-15-10-19-14-8-5-4-7-13(14)17(15)21/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H2,18,22)
InChIKeySGZFJJYUTCXHST-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.11
Rot. Bonds5

About 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide

3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide (PubChem CID 91392290) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide.

Molecular Properties

Compound Name3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide
PubChem CID91392290
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide
SMILESCCCC(CC(N)=O)n1c(C)nc2cnc3ccccc3c21
InChIInChI=1S/C17H20N4O/c1-3-6-12(9-16(18)22)21-11(2)20-15-10-19-14-8-5-4-7-13(14)17(15)21/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H2,18,22)
InChIKeySGZFJJYUTCXHST-UHFFFAOYSA-N
XLogP3.11
TPSA73.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide 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-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide?
The IUPAC name of 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide (CID 91392290) is 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide.
What is the SMILES notation for 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide?
The canonical SMILES for 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide is CCCC(CC(N)=O)n1c(C)nc2cnc3ccccc3c21.
What is the InChIKey of 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide?
The InChIKey is SGZFJJYUTCXHST-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c1-3-6-12(9-16(18)22)21-11(2)20-15-10-19-14-8-5-4-7-13(14)17(15)21/h4-5,7-8,10,12H,3,6,9H2,1-2H3,(H2,18,22).
What are the key properties of 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide?
3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide has a molecular weight of 296.37 g/mol, XLogP of 3.11, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methylimidazo[4,5-c]quinolin-1-yl)hexanamide is sourced from PubChem (CID 91392290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).