3-methylidene-7-methylsulfanyl-1,2-dihydroindene

C11H12S — CID 91197191

IUPAC3-methylidene-7-methylsulfanyl-1,2-dihydroindene
SMILESC=C1CCc2c(SC)cccc21
InChIInChI=1S/C11H12S/c1-8-6-7-10-9(8)4-3-5-11(10)12-2/h3-5H,1,6-7H2,2H3
InChIKeySVIJBNQGPOVYQJ-UHFFFAOYSA-N
MW176.28 g/mol
LogP3.37
Rot. Bonds1

About 3-methylidene-7-methylsulfanyl-1,2-dihydroindene

3-methylidene-7-methylsulfanyl-1,2-dihydroindene (PubChem CID 91197191) has the molecular formula C11H12S and a molecular weight of 176.28 g/mol. Its IUPAC name is 3-methylidene-7-methylsulfanyl-1,2-dihydroindene.

Molecular Properties

Compound Name3-methylidene-7-methylsulfanyl-1,2-dihydroindene
PubChem CID91197191
Molecular FormulaC11H12S
Molecular Weight176.28 g/mol
Exact Mass176.07
IUPAC Name3-methylidene-7-methylsulfanyl-1,2-dihydroindene
SMILESC=C1CCc2c(SC)cccc21
InChIInChI=1S/C11H12S/c1-8-6-7-10-9(8)4-3-5-11(10)12-2/h3-5H,1,6-7H2,2H3
InChIKeySVIJBNQGPOVYQJ-UHFFFAOYSA-N
XLogP3.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.28
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-methylidene-7-methylsulfanyl-1,2-dihydroindene 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

1-methylidene-2,3-dihydroinden-4-amine
CID 143813734
7-tert-butyl-3-methylidene-1,2-dihydroindene
CID 59813046
5-methylsulfanyl-1-propan-2-yl-3,4-dihydroquinolin-2-one
CID 135200247
2-ethenyl-1,3-bis(methylsulfanyl)benzene
CID 54025667
5-methylsulfanyl-1-(methylsulfanylmethyl)-3,4-dihydroquinolin-2-one
CID 146510351
1-methylsulfanyl-2-(3-methylsulfanylphenyl)benzene
CID 71281372
3-(2-methylsulfanylphenyl)cyclohex-2-en-1-one
CID 86216914
azane;2-methyl-1,3-bis(methylsulfanyl)benzene
CID 18755719
(2S)-2-methyl-4-methylsulfanyl-2,3-dihydro-1H-indole
CID 130614963
N-[3-[2-(7-methylsulfanyl-2-tricyclo[9.4.0.03,8]pentadeca-1(15),3(8),4,6,11,13-hexaenylidene)ethenyl]phenyl]methanesulfonamide
CID 89250740
2-(2-methylsulfanylphenyl)benzonitrile
CID 56776794
[(1R)-5-methylsulfanyl-1,2,3,4-tetrahydroisoquinolin-1-yl]methanol
CID 130607756

Frequently Asked Questions

What is the IUPAC name of 3-methylidene-7-methylsulfanyl-1,2-dihydroindene?
The IUPAC name of 3-methylidene-7-methylsulfanyl-1,2-dihydroindene (CID 91197191) is 3-methylidene-7-methylsulfanyl-1,2-dihydroindene.
What is the SMILES notation for 3-methylidene-7-methylsulfanyl-1,2-dihydroindene?
The canonical SMILES for 3-methylidene-7-methylsulfanyl-1,2-dihydroindene is C=C1CCc2c(SC)cccc21.
What is the InChIKey of 3-methylidene-7-methylsulfanyl-1,2-dihydroindene?
The InChIKey is SVIJBNQGPOVYQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12S/c1-8-6-7-10-9(8)4-3-5-11(10)12-2/h3-5H,1,6-7H2,2H3.
What are the key properties of 3-methylidene-7-methylsulfanyl-1,2-dihydroindene?
3-methylidene-7-methylsulfanyl-1,2-dihydroindene has a molecular weight of 176.28 g/mol, XLogP of 3.37, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methylidene-7-methylsulfanyl-1,2-dihydroindene is sourced from PubChem (CID 91197191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).