2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one

C14H15NO2 — CID 103446086

IUPAC2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one
SMILESCc1ccc2cc(C(=O)C(C)(C)O)ccc2n1
InChIInChI=1S/C14H15NO2/c1-9-4-5-10-8-11(6-7-12(10)15-9)13(16)14(2,3)17/h4-8,17H,1-3H3
InChIKeyWZRJYAKLWBCLIX-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.50
Rot. Bonds2

About 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one

2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one (PubChem CID 103446086) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one.

Molecular Properties

Compound Name2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one
PubChem CID103446086
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one
SMILESCc1ccc2cc(C(=O)C(C)(C)O)ccc2n1
InChIInChI=1S/C14H15NO2/c1-9-4-5-10-8-11(6-7-12(10)15-9)13(16)14(2,3)17/h4-8,17H,1-3H3
InChIKeyWZRJYAKLWBCLIX-UHFFFAOYSA-N
XLogP2.50
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one 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-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one?
The IUPAC name of 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one (CID 103446086) is 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one.
What is the SMILES notation for 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one?
The canonical SMILES for 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one is Cc1ccc2cc(C(=O)C(C)(C)O)ccc2n1.
What is the InChIKey of 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one?
The InChIKey is WZRJYAKLWBCLIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-9-4-5-10-8-11(6-7-12(10)15-9)13(16)14(2,3)17/h4-8,17H,1-3H3.
What are the key properties of 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one?
2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one has a molecular weight of 229.28 g/mol, XLogP of 2.50, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-methyl-1-(2-methylquinolin-6-yl)propan-1-one is sourced from PubChem (CID 103446086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).