6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one

C15H20O2 — CID 53462368

IUPAC6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one
SMILESCOCCc1c(C)cc2c(c1C)C(=O)C(C)C2
InChIInChI=1S/C15H20O2/c1-9-7-12-8-10(2)15(16)14(12)11(3)13(9)5-6-17-4/h7,10H,5-6,8H2,1-4H3
InChIKeyYGMHYALYIOLFQS-UHFFFAOYSA-N
MW232.32 g/mol
LogP2.87
Rot. Bonds3

About 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one

6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one (PubChem CID 53462368) has the molecular formula C15H20O2 and a molecular weight of 232.32 g/mol. Its IUPAC name is 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one.

Molecular Properties

Compound Name6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one
PubChem CID53462368
Molecular FormulaC15H20O2
Molecular Weight232.32 g/mol
Exact Mass232.15
IUPAC Name6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one
SMILESCOCCc1c(C)cc2c(c1C)C(=O)C(C)C2
InChIInChI=1S/C15H20O2/c1-9-7-12-8-10(2)15(16)14(12)11(3)13(9)5-6-17-4/h7,10H,5-6,8H2,1-4H3
InChIKeyYGMHYALYIOLFQS-UHFFFAOYSA-N
XLogP2.87
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.32
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 6-(2-methoxyethyl)-2,5,7-trimethyl-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

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one?
The IUPAC name of 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one (CID 53462368) is 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one.
What is the SMILES notation for 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one?
The canonical SMILES for 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one is COCCc1c(C)cc2c(c1C)C(=O)C(C)C2.
What is the InChIKey of 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one?
The InChIKey is YGMHYALYIOLFQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O2/c1-9-7-12-8-10(2)15(16)14(12)11(3)13(9)5-6-17-4/h7,10H,5-6,8H2,1-4H3.
What are the key properties of 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one?
6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one has a molecular weight of 232.32 g/mol, XLogP of 2.87, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethyl)-2,5,7-trimethyl-2,3-dihydroinden-1-one is sourced from PubChem (CID 53462368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).