5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene

C25H24O3 — CID 153469908

IUPAC5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene
SMILESCOCCOc1ccc(COc2ccc3c(c2)C=C(c2ccccc2)C3)cc1
InChIInChI=1S/C25H24O3/c1-26-13-14-27-24-10-7-19(8-11-24)18-28-25-12-9-21-15-22(16-23(21)17-25)20-5-3-2-4-6-20/h2-12,16-17H,13-15,18H2,1H3
InChIKeyKEVHDROHABIQAB-UHFFFAOYSA-N
MW372.46 g/mol
LogP5.39
Rot. Bonds8

About 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene

5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene (PubChem CID 153469908) has the molecular formula C25H24O3 and a molecular weight of 372.46 g/mol. Its IUPAC name is 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene.

Molecular Properties

Compound Name5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene
PubChem CID153469908
Molecular FormulaC25H24O3
Molecular Weight372.46 g/mol
Exact Mass372.17
IUPAC Name5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene
SMILESCOCCOc1ccc(COc2ccc3c(c2)C=C(c2ccccc2)C3)cc1
InChIInChI=1S/C25H24O3/c1-26-13-14-27-24-10-7-19(8-11-24)18-28-25-12-9-21-15-22(16-23(21)17-25)20-5-3-2-4-6-20/h2-12,16-17H,13-15,18H2,1H3
InChIKeyKEVHDROHABIQAB-UHFFFAOYSA-N
XLogP5.39
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.46
LogP ≤ 55.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-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

Frequently Asked Questions

What is the IUPAC name of 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene?
The IUPAC name of 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene (CID 153469908) is 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene.
What is the SMILES notation for 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene?
The canonical SMILES for 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene is COCCOc1ccc(COc2ccc3c(c2)C=C(c2ccccc2)C3)cc1.
What is the InChIKey of 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene?
The InChIKey is KEVHDROHABIQAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24O3/c1-26-13-14-27-24-10-7-19(8-11-24)18-28-25-12-9-21-15-22(16-23(21)17-25)20-5-3-2-4-6-20/h2-12,16-17H,13-15,18H2,1H3.
What are the key properties of 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene?
5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene has a molecular weight of 372.46 g/mol, XLogP of 5.39, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-(2-methoxyethoxy)phenyl]methoxy]-2-phenyl-1H-indene is sourced from PubChem (CID 153469908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).