2-(methoxymethyl)-2,3-dihydroinden-1-one

C11H12O2 — CID 71409050

IUPAC2-(methoxymethyl)-2,3-dihydroinden-1-one
SMILESCOCC1Cc2ccccc2C1=O
InChIInChI=1S/C11H12O2/c1-13-7-9-6-8-4-2-3-5-10(8)11(9)12/h2-5,9H,6-7H2,1H3
InChIKeyWWPZKOMOAPKNEQ-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.69
Rot. Bonds2

About 2-(methoxymethyl)-2,3-dihydroinden-1-one

2-(methoxymethyl)-2,3-dihydroinden-1-one (PubChem CID 71409050) has the molecular formula C11H12O2 and a molecular weight of 176.22 g/mol. Its IUPAC name is 2-(methoxymethyl)-2,3-dihydroinden-1-one.

Molecular Properties

Compound Name2-(methoxymethyl)-2,3-dihydroinden-1-one
PubChem CID71409050
Molecular FormulaC11H12O2
Molecular Weight176.22 g/mol
Exact Mass176.08
IUPAC Name2-(methoxymethyl)-2,3-dihydroinden-1-one
SMILESCOCC1Cc2ccccc2C1=O
InChIInChI=1S/C11H12O2/c1-13-7-9-6-8-4-2-3-5-10(8)11(9)12/h2-5,9H,6-7H2,1H3
InChIKeyWWPZKOMOAPKNEQ-UHFFFAOYSA-N
XLogP1.69
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(methoxymethyl)-2,3-dihydroinden-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

Related Compounds

(2R)-2-[[(2R)-3-oxo-1,2-dihydroinden-2-yl]methyl]-2,3-dihydroinden-1-one
CID 910021
2-[(4-ethylphenyl)methyl]-2,3-dihydroinden-1-one
CID 15544001
(2R)-2-[[methyl(propan-2-yl)amino]methyl]-2,3-dihydroinden-1-one
CID 129365333
2-(2-fluoroethyl)-2,3-dihydroinden-1-one
CID 80695760
(2S)-2-but-2-enyl-2,3-dihydroinden-1-one
CID 67713890
2-[(4-methylphenyl)methyl]-2,3-dihydroinden-1-one
CID 15544000
(3R)-3-(methoxymethyl)-3,4-dihydrochromen-2-one
CID 14941867
2-[(4-tert-butylphenyl)methyl]-2,3-dihydroinden-1-one
CID 63399290
(2S)-2-methyl-2,3-dihydroinden-1-one
CID 6994407
2-[2,2-bis(diethoxyphosphoryl)ethyl]-2,3-dihydroinden-1-one
CID 10477908
2-(2-methyl-2-nitropropyl)-2,3-dihydroinden-1-one
CID 12733660
2-(5-aminopentyl)-2,3-dihydroinden-1-one
CID 23389014

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-2,3-dihydroinden-1-one?
The IUPAC name of 2-(methoxymethyl)-2,3-dihydroinden-1-one (CID 71409050) is 2-(methoxymethyl)-2,3-dihydroinden-1-one.
What is the SMILES notation for 2-(methoxymethyl)-2,3-dihydroinden-1-one?
The canonical SMILES for 2-(methoxymethyl)-2,3-dihydroinden-1-one is COCC1Cc2ccccc2C1=O.
What is the InChIKey of 2-(methoxymethyl)-2,3-dihydroinden-1-one?
The InChIKey is WWPZKOMOAPKNEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O2/c1-13-7-9-6-8-4-2-3-5-10(8)11(9)12/h2-5,9H,6-7H2,1H3.
What are the key properties of 2-(methoxymethyl)-2,3-dihydroinden-1-one?
2-(methoxymethyl)-2,3-dihydroinden-1-one has a molecular weight of 176.22 g/mol, XLogP of 1.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-2,3-dihydroinden-1-one is sourced from PubChem (CID 71409050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).