methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene

C25H36 — CID 161247777

IUPACmethane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene
SMILESC.Cc1cc2c(cc1C)C(C)CC2.Cc1cc2c(cc1C)CC(C)C2
InChIInChI=1S/2C12H16.CH4/c1-8-4-11-6-9(2)10(3)7-12(11)5-8;1-8-4-5-11-6-9(2)10(3)7-12(8)11;/h2*6-8H,4-5H2,1-3H3;1H4
InChIKeyVAWBQCXVGFJXTO-UHFFFAOYSA-N
MW336.56 g/mol
LogP7.03
Rot. Bonds

About methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene

methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene (PubChem CID 161247777) has the molecular formula C25H36 and a molecular weight of 336.56 g/mol. Its IUPAC name is methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene.

Molecular Properties

Compound Namemethane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene
PubChem CID161247777
Molecular FormulaC25H36
Molecular Weight336.56 g/mol
Exact Mass336.28
IUPAC Namemethane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene
SMILESC.Cc1cc2c(cc1C)C(C)CC2.Cc1cc2c(cc1C)CC(C)C2
InChIInChI=1S/2C12H16.CH4/c1-8-4-11-6-9(2)10(3)7-12(11)5-8;1-8-4-5-11-6-9(2)10(3)7-12(8)11;/h2*6-8H,4-5H2,1-3H3;1H4
InChIKeyVAWBQCXVGFJXTO-UHFFFAOYSA-N
XLogP7.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500336.56
LogP ≤ 57.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-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

1,6-dimethyl-2,3-dihydro-1H-inden-5-ol
CID 71371609
N,2,3,7-tetramethyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-amine
CID 115483167
1-methyl-2,3-dihydro-1H-indene-5-thiol
CID 176565119
6,7-dimethyl-1,2,3,4-tetrahydronaphthalen-2-ol
CID 142618185
4-(1-methyl-2,3-dihydro-1H-inden-5-yl)piperidine
CID 58663062
4,8,14-trimethyltricyclo[9.4.0.02,7]pentadeca-1(11),2(7),3,5,12,14-hexaene
CID 142288787
2-butan-2-yl-6,7-dimethyl-1,2,3,4-tetrahydronaphthalene
CID 123872864
2,7-dimethyl-1,2,3,4-tetrahydronaphthalene;ethane
CID 145046662
(1S)-6,7-dimethyl-1,2,3,4-tetrahydronaphthalen-1-amine;hydrochloride
CID 162344374
6,7-dichloro-2-methyl-1,2,3,4-tetrahydronaphthalene
CID 150751811
1-methyl-2,3-dihydro-1H-indene-5-carboxamide
CID 70321993
5,6-dimethyl-2,3-dihydro-1H-inden-2-ol
CID 86145079

Frequently Asked Questions

What is the IUPAC name of methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene?
The IUPAC name of methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene (CID 161247777) is methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene.
What is the SMILES notation for methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene?
The canonical SMILES for methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene is C.Cc1cc2c(cc1C)C(C)CC2.Cc1cc2c(cc1C)CC(C)C2.
What is the InChIKey of methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene?
The InChIKey is VAWBQCXVGFJXTO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C12H16.CH4/c1-8-4-11-6-9(2)10(3)7-12(11)5-8;1-8-4-5-11-6-9(2)10(3)7-12(8)11;/h2*6-8H,4-5H2,1-3H3;1H4.
What are the key properties of methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene?
methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene has a molecular weight of 336.56 g/mol, XLogP of 7.03, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methane;1,5,6-trimethyl-2,3-dihydro-1H-indene;2,5,6-trimethyl-2,3-dihydro-1H-indene is sourced from PubChem (CID 161247777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).