4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid

C15H15NO2 — CID 4895764

IUPAC4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid
SMILESCN1CC(C(=O)O)Cc2c1ccc1ccccc21
InChIInChI=1S/C15H15NO2/c1-16-9-11(15(17)18)8-13-12-5-3-2-4-10(12)6-7-14(13)16/h2-7,11H,8-9H2,1H3,(H,17,18)
InChIKeyGGNBIXQFUHIOOZ-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.53
Rot. Bonds1

About 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid

4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid (PubChem CID 4895764) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid.

Molecular Properties

Compound Name4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid
PubChem CID4895764
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid
SMILESCN1CC(C(=O)O)Cc2c1ccc1ccccc21
InChIInChI=1S/C15H15NO2/c1-16-9-11(15(17)18)8-13-12-5-3-2-4-10(12)6-7-14(13)16/h2-7,11H,8-9H2,1H3,(H,17,18)
InChIKeyGGNBIXQFUHIOOZ-UHFFFAOYSA-N
XLogP2.53
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid 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 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid?
The IUPAC name of 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid (CID 4895764) is 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid.
What is the SMILES notation for 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid?
The canonical SMILES for 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid is CN1CC(C(=O)O)Cc2c1ccc1ccccc21.
What is the InChIKey of 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid?
The InChIKey is GGNBIXQFUHIOOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-16-9-11(15(17)18)8-13-12-5-3-2-4-10(12)6-7-14(13)16/h2-7,11H,8-9H2,1H3,(H,17,18).
What are the key properties of 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid?
4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid has a molecular weight of 241.29 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2,3-dihydro-1H-benzo[f]quinoline-2-carboxylic acid is sourced from PubChem (CID 4895764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).