2-(2,2-diphenylethenyl)-3-methyl-1H-indene

C24H20 — CID 10542850

IUPAC2-(2,2-diphenylethenyl)-3-methyl-1H-indene
SMILESCC1=C(C=C(c2ccccc2)c2ccccc2)Cc2ccccc21
InChIInChI=1S/C24H20/c1-18-22(16-21-14-8-9-15-23(18)21)17-24(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-15,17H,16H2,1H3
InChIKeySBZQIHJVLTZXPU-UHFFFAOYSA-N
MW308.42 g/mol
LogP6.15
Rot. Bonds3

About 2-(2,2-diphenylethenyl)-3-methyl-1H-indene

2-(2,2-diphenylethenyl)-3-methyl-1H-indene (PubChem CID 10542850) has the molecular formula C24H20 and a molecular weight of 308.42 g/mol. Its IUPAC name is 2-(2,2-diphenylethenyl)-3-methyl-1H-indene.

Molecular Properties

Compound Name2-(2,2-diphenylethenyl)-3-methyl-1H-indene
PubChem CID10542850
Molecular FormulaC24H20
Molecular Weight308.42 g/mol
Exact Mass308.16
IUPAC Name2-(2,2-diphenylethenyl)-3-methyl-1H-indene
SMILESCC1=C(C=C(c2ccccc2)c2ccccc2)Cc2ccccc21
InChIInChI=1S/C24H20/c1-18-22(16-21-14-8-9-15-23(18)21)17-24(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-15,17H,16H2,1H3
InChIKeySBZQIHJVLTZXPU-UHFFFAOYSA-N
XLogP6.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500308.42
LogP ≤ 56.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-diphenylethenyl)-3-methyl-1H-indene?
The IUPAC name of 2-(2,2-diphenylethenyl)-3-methyl-1H-indene (CID 10542850) is 2-(2,2-diphenylethenyl)-3-methyl-1H-indene.
What is the SMILES notation for 2-(2,2-diphenylethenyl)-3-methyl-1H-indene?
The canonical SMILES for 2-(2,2-diphenylethenyl)-3-methyl-1H-indene is CC1=C(C=C(c2ccccc2)c2ccccc2)Cc2ccccc21.
What is the InChIKey of 2-(2,2-diphenylethenyl)-3-methyl-1H-indene?
The InChIKey is SBZQIHJVLTZXPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20/c1-18-22(16-21-14-8-9-15-23(18)21)17-24(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h2-15,17H,16H2,1H3.
What are the key properties of 2-(2,2-diphenylethenyl)-3-methyl-1H-indene?
2-(2,2-diphenylethenyl)-3-methyl-1H-indene has a molecular weight of 308.42 g/mol, XLogP of 6.15, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-diphenylethenyl)-3-methyl-1H-indene is sourced from PubChem (CID 10542850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).