2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene

C22H22 — CID 54474660

IUPAC2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene
SMILESCC1=Cc2ccccc2C1CCC1=C(C)Cc2ccccc21
InChIInChI=1S/C22H22/c1-15-13-17-7-3-5-9-21(17)19(15)11-12-20-16(2)14-18-8-4-6-10-22(18)20/h3-10,13,19H,11-12,14H2,1-2H3
InChIKeyIOLQJYJQHRLDMV-UHFFFAOYSA-N
MW286.42 g/mol
LogP6.00
Rot. Bonds3

About 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene

2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene (PubChem CID 54474660) has the molecular formula C22H22 and a molecular weight of 286.42 g/mol. Its IUPAC name is 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene.

Molecular Properties

Compound Name2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene
PubChem CID54474660
Molecular FormulaC22H22
Molecular Weight286.42 g/mol
Exact Mass286.17
IUPAC Name2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene
SMILESCC1=Cc2ccccc2C1CCC1=C(C)Cc2ccccc21
InChIInChI=1S/C22H22/c1-15-13-17-7-3-5-9-21(17)19(15)11-12-20-16(2)14-18-8-4-6-10-22(18)20/h3-10,13,19H,11-12,14H2,1-2H3
InChIKeyIOLQJYJQHRLDMV-UHFFFAOYSA-N
XLogP6.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.42
LogP ≤ 56.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-methyl-3-[2-(2-methyl-1H-inden-1-yl)ethyl]-9H-cyclopenta[b]naphthalene
CID 173041017
3-butyl-2-methyl-1H-indene
CID 15422807
2-methyl-1-[4-(2-methyl-7-phenyl-3H-inden-1-yl)butyl]-7-phenyl-1H-indene
CID 57259609
1-ethyl-2-methyl-1H-indene
CID 12910549
3,6-ditert-butyl-9-[2-(2-methyl-1H-inden-1-yl)ethyl]-9H-fluorene
CID 91296033
6-methyl-7-[2-(2-methyl-1H-inden-1-yl)ethyl]-8aH-cyclopenta[f][1,3]benzodioxole
CID 87245672
4-bromo-1-[2-(9H-fluoren-9-yl)ethyl]-2-methyl-4H-cyclopenta[b]naphthalene
CID 67040034
3-(9H-fluoren-9-ylmethyl)-2-methyl-9H-cyclopenta[b]naphthalene
CID 90973968
2-(2-methyl-1H-inden-1-yl)acetic acid
CID 150876820
6-bromo-3-[2-(1H-inden-2-yl)ethyl]-2,9-dimethyl-3H-cyclopenta[b]naphthalene
CID 67040087
4-bromo-7-[2-(1H-inden-2-yl)ethyl]-6-methyl-7H-cyclopenta[f][1,3]benzodioxole
CID 67039646
bis(2-methyl-1H-inden-1-yl)silane
CID 154500398

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene?
The IUPAC name of 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene (CID 54474660) is 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene.
What is the SMILES notation for 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene?
The canonical SMILES for 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene is CC1=Cc2ccccc2C1CCC1=C(C)Cc2ccccc21.
What is the InChIKey of 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene?
The InChIKey is IOLQJYJQHRLDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22/c1-15-13-17-7-3-5-9-21(17)19(15)11-12-20-16(2)14-18-8-4-6-10-22(18)20/h3-10,13,19H,11-12,14H2,1-2H3.
What are the key properties of 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene?
2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene has a molecular weight of 286.42 g/mol, XLogP of 6.00, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[2-(2-methyl-3H-inden-1-yl)ethyl]-1H-indene is sourced from PubChem (CID 54474660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).