diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol

C27H26O — CID 141067091

IUPACdiphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol
SMILESCC1=CC(C)=C(C)C1c1ccccc1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H26O/c1-19-18-20(2)26(21(19)3)24-16-10-11-17-25(24)27(28,22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-18,26,28H,1-3H3
InChIKeyBDMZPYAGUFVDLZ-UHFFFAOYSA-N
MW366.50 g/mol
LogP6.35
Rot. Bonds4

About diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol

diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol (PubChem CID 141067091) has the molecular formula C27H26O and a molecular weight of 366.50 g/mol. Its IUPAC name is diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol.

Molecular Properties

Compound Namediphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol
PubChem CID141067091
Molecular FormulaC27H26O
Molecular Weight366.50 g/mol
Exact Mass366.20
IUPAC Namediphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol
SMILESCC1=CC(C)=C(C)C1c1ccccc1C(O)(c1ccccc1)c1ccccc1
InChIInChI=1S/C27H26O/c1-19-18-20(2)26(21(19)3)24-16-10-11-17-25(24)27(28,22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-18,26,28H,1-3H3
InChIKeyBDMZPYAGUFVDLZ-UHFFFAOYSA-N
XLogP6.35
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.50
LogP ≤ 56.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol?
The IUPAC name of diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol (CID 141067091) is diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol.
What is the SMILES notation for diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol?
The canonical SMILES for diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol is CC1=CC(C)=C(C)C1c1ccccc1C(O)(c1ccccc1)c1ccccc1.
What is the InChIKey of diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol?
The InChIKey is BDMZPYAGUFVDLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26O/c1-19-18-20(2)26(21(19)3)24-16-10-11-17-25(24)27(28,22-12-6-4-7-13-22)23-14-8-5-9-15-23/h4-18,26,28H,1-3H3.
What are the key properties of diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol?
diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol has a molecular weight of 366.50 g/mol, XLogP of 6.35, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyl-[2-(2,3,5-trimethylcyclopenta-2,4-dien-1-yl)phenyl]methanol is sourced from PubChem (CID 141067091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).