2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol

C23H20O2 — CID 24954726

IUPAC2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol
SMILESCc1cc(C2=C(c3ccccc3)c3cc(O)cc(C)c3C2)ccc1O
InChIInChI=1S/C23H20O2/c1-14-11-18(24)12-21-19(14)13-20(17-8-9-22(25)15(2)10-17)23(21)16-6-4-3-5-7-16/h3-12,24-25H,13H2,1-2H3
InChIKeyXOZDVVQIQSPGSV-UHFFFAOYSA-N
MW328.41 g/mol
LogP5.23
Rot. Bonds2

About 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol

2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol (PubChem CID 24954726) has the molecular formula C23H20O2 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol.

Molecular Properties

Compound Name2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol
PubChem CID24954726
Molecular FormulaC23H20O2
Molecular Weight328.41 g/mol
Exact Mass328.15
IUPAC Name2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol
SMILESCc1cc(C2=C(c3ccccc3)c3cc(O)cc(C)c3C2)ccc1O
InChIInChI=1S/C23H20O2/c1-14-11-18(24)12-21-19(14)13-20(17-8-9-22(25)15(2)10-17)23(21)16-6-4-3-5-7-16/h3-12,24-25H,13H2,1-2H3
InChIKeyXOZDVVQIQSPGSV-UHFFFAOYSA-N
XLogP5.23
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.41
LogP ≤ 55.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

CID 8663
CID 8663
CID 667476
CID 667476
CID 7005
CID 7005
CID 72300
CID 72300
CID 192197
CID 192197
CID 66166
CID 66166
CID 72303
CID 72303
CID 10229
CID 10229
CID 21387
CID 21387
CID 6620
CID 6620
CID 6815
CID 6815
CID 232446
CID 232446

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol?
The IUPAC name of 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol (CID 24954726) is 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol.
What is the SMILES notation for 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol?
The canonical SMILES for 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol is Cc1cc(C2=C(c3ccccc3)c3cc(O)cc(C)c3C2)ccc1O.
What is the InChIKey of 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol?
The InChIKey is XOZDVVQIQSPGSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20O2/c1-14-11-18(24)12-21-19(14)13-20(17-8-9-22(25)15(2)10-17)23(21)16-6-4-3-5-7-16/h3-12,24-25H,13H2,1-2H3.
What are the key properties of 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol?
2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol has a molecular weight of 328.41 g/mol, XLogP of 5.23, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-3-methylphenyl)-7-methyl-3-phenyl-1H-inden-5-ol is sourced from PubChem (CID 24954726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).