1,3-dimethyl-4,5-dihydro-2H-indene

C11H14 — CID 158841865

IUPAC1,3-dimethyl-4,5-dihydro-2H-indene
SMILESCC1=C2C=CCCC2=C(C)C1
InChIInChI=1S/C11H14/c1-8-7-9(2)11-6-4-3-5-10(8)11/h3,5H,4,6-7H2,1-2H3
InChIKeyLGWVZTBFURTZKG-UHFFFAOYSA-N
MW146.23 g/mol
LogP3.37
Rot. Bonds

About 1,3-dimethyl-4,5-dihydro-2H-indene

1,3-dimethyl-4,5-dihydro-2H-indene (PubChem CID 158841865) has the molecular formula C11H14 and a molecular weight of 146.23 g/mol. Its IUPAC name is 1,3-dimethyl-4,5-dihydro-2H-indene.

Molecular Properties

Compound Name1,3-dimethyl-4,5-dihydro-2H-indene
PubChem CID158841865
Molecular FormulaC11H14
Molecular Weight146.23 g/mol
Exact Mass146.11
IUPAC Name1,3-dimethyl-4,5-dihydro-2H-indene
SMILESCC1=C2C=CCCC2=C(C)C1
InChIInChI=1S/C11H14/c1-8-7-9(2)11-6-4-3-5-10(8)11/h3,5H,4,6-7H2,1-2H3
InChIKeyLGWVZTBFURTZKG-UHFFFAOYSA-N
XLogP3.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,3-dimethyl-4,5-dihydro-2H-indene 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 1,3-dimethyl-4,5-dihydro-2H-indene?
The IUPAC name of 1,3-dimethyl-4,5-dihydro-2H-indene (CID 158841865) is 1,3-dimethyl-4,5-dihydro-2H-indene.
What is the SMILES notation for 1,3-dimethyl-4,5-dihydro-2H-indene?
The canonical SMILES for 1,3-dimethyl-4,5-dihydro-2H-indene is CC1=C2C=CCCC2=C(C)C1.
What is the InChIKey of 1,3-dimethyl-4,5-dihydro-2H-indene?
The InChIKey is LGWVZTBFURTZKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14/c1-8-7-9(2)11-6-4-3-5-10(8)11/h3,5H,4,6-7H2,1-2H3.
What are the key properties of 1,3-dimethyl-4,5-dihydro-2H-indene?
1,3-dimethyl-4,5-dihydro-2H-indene has a molecular weight of 146.23 g/mol, XLogP of 3.37, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4,5-dihydro-2H-indene is sourced from PubChem (CID 158841865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).