3-methyl-7,7a-dihydro-1H-indene

C10H12 — CID 90996575

IUPAC3-methyl-7,7a-dihydro-1H-indene
SMILESCC1=CCC2CC=CC=C12
InChIInChI=1S/C10H12/c1-8-6-7-9-4-2-3-5-10(8)9/h2-3,5-6,9H,4,7H2,1H3
InChIKeyYUGIKXDQXQGGGX-UHFFFAOYSA-N
MW132.21 g/mol
LogP2.84
Rot. Bonds

About 3-methyl-7,7a-dihydro-1H-indene

3-methyl-7,7a-dihydro-1H-indene (PubChem CID 90996575) has the molecular formula C10H12 and a molecular weight of 132.21 g/mol. Its IUPAC name is 3-methyl-7,7a-dihydro-1H-indene.

Molecular Properties

Compound Name3-methyl-7,7a-dihydro-1H-indene
PubChem CID90996575
Molecular FormulaC10H12
Molecular Weight132.21 g/mol
Exact Mass132.09
IUPAC Name3-methyl-7,7a-dihydro-1H-indene
SMILESCC1=CCC2CC=CC=C12
InChIInChI=1S/C10H12/c1-8-6-7-9-4-2-3-5-10(8)9/h2-3,5-6,9H,4,7H2,1H3
InChIKeyYUGIKXDQXQGGGX-UHFFFAOYSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.21
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3-methyl-7,7a-dihydro-1H-indene 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

N-hydroxy-7-methyl-9,9a-dihydro-1H-benzo[7]annulene-6-carboxamide
CID 90925920
1,2,3,6,6a,7-hexahydrochrysene
CID 174873535
2-(6-hydroxycyclohexa-1,3-dien-1-yl)cyclohexa-2,4-dien-1-ol
CID 123397571
2-methyl-2,3,3a,4-tetrahydroindol-1-ide
CID 19835384
2-fluoro-2,3,3a,4-tetrahydroinden-1-one
CID 151740601
2-cyclopropyl-1,3-dimethylcyclohepta-1,3,5-triene
CID 121009040
2-bromo-2-methyl-3,4,4a,5-tetrahydronaphthalen-1-one
CID 170944222
2,3,4,4a,5,6,6a,7-octahydrophenanthridine
CID 91176715
3,4,4a,5-tetrahydro-2H-isoquinolin-1-one;hydrate
CID 156773047
tricyclo[10.4.0.04,9]hexadeca-1(16),6,8,10,14-pentaen-2-imine
CID 56995744
2-methyl-1,3,3a,4-tetrahydroisoindole
CID 66962228
9-(5-methylcyclohexa-1,5-dien-1-yl)-1,9,10,10a-tetrahydrophenanthrene
CID 123504389

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7,7a-dihydro-1H-indene?
The IUPAC name of 3-methyl-7,7a-dihydro-1H-indene (CID 90996575) is 3-methyl-7,7a-dihydro-1H-indene.
What is the SMILES notation for 3-methyl-7,7a-dihydro-1H-indene?
The canonical SMILES for 3-methyl-7,7a-dihydro-1H-indene is CC1=CCC2CC=CC=C12.
What is the InChIKey of 3-methyl-7,7a-dihydro-1H-indene?
The InChIKey is YUGIKXDQXQGGGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12/c1-8-6-7-9-4-2-3-5-10(8)9/h2-3,5-6,9H,4,7H2,1H3.
What are the key properties of 3-methyl-7,7a-dihydro-1H-indene?
3-methyl-7,7a-dihydro-1H-indene has a molecular weight of 132.21 g/mol, XLogP of 2.84, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7,7a-dihydro-1H-indene is sourced from PubChem (CID 90996575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).