3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran

C27H24O2 — CID 135022466

IUPAC3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran
SMILESC=CCc1oc(-c2ccccc2)c(-c2ccc(OCC)cc2)c1-c1ccccc1
InChIInChI=1S/C27H24O2/c1-3-11-24-25(20-12-7-5-8-13-20)26(21-16-18-23(19-17-21)28-4-2)27(29-24)22-14-9-6-10-15-22/h3,5-10,12-19H,1,4,11H2,2H3
InChIKeyBCRZHXACUOMCPD-UHFFFAOYSA-N
MW380.49 g/mol
LogP7.41
Rot. Bonds7

About 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran

3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran (PubChem CID 135022466) has the molecular formula C27H24O2 and a molecular weight of 380.49 g/mol. Its IUPAC name is 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran.

Molecular Properties

Compound Name3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran
PubChem CID135022466
Molecular FormulaC27H24O2
Molecular Weight380.49 g/mol
Exact Mass380.18
IUPAC Name3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran
SMILESC=CCc1oc(-c2ccccc2)c(-c2ccc(OCC)cc2)c1-c1ccccc1
InChIInChI=1S/C27H24O2/c1-3-11-24-25(20-12-7-5-8-13-20)26(21-16-18-23(19-17-21)28-4-2)27(29-24)22-14-9-6-10-15-22/h3,5-10,12-19H,1,4,11H2,2H3
InChIKeyBCRZHXACUOMCPD-UHFFFAOYSA-N
XLogP7.41
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500380.49
LogP ≤ 57.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran with MolForge

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

Launch Full Analysis

Related Compounds

1-ethoxy-4-phenylbenzene;phenol
CID 174652155
3-ethoxy-1-(4-ethoxyphenyl)-2,4-bis(prop-2-enyl)benzene
CID 173362831
(4-phenylphenyl) 2-(4-ethoxyphenoxy)acetate
CID 19177827
1-(ethoxymethoxy)-4-phenylbenzene
CID 146557132
2-(4-ethoxyphenyl)-6-prop-2-enoxynaphthalene
CID 139863903
9-(4-ethoxyphenyl)acridine
CID 18966036
2-(4-ethoxyphenyl)-6-phenylthiopyrylium
CID 154276267
ethoxybenzene chloride
CID 21193593
3-(4-ethoxyphenyl)-4,5-diphenyl-1,3-oxazol-2-one
CID 95170020
4-(benzenesulfonyl)-2-(4-ethoxyphenyl)-N-prop-2-enyl-1,3-oxazol-5-amine
CID 18826076
1-ethoxy-4-(1-phenylprop-2-enyl)benzene
CID 57277088
4-(4-ethoxyphenyl)-5-methyl-1,2-oxazol-3-amine
CID 66199638

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran?
The IUPAC name of 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran (CID 135022466) is 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran.
What is the SMILES notation for 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran?
The canonical SMILES for 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran is C=CCc1oc(-c2ccccc2)c(-c2ccc(OCC)cc2)c1-c1ccccc1.
What is the InChIKey of 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran?
The InChIKey is BCRZHXACUOMCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H24O2/c1-3-11-24-25(20-12-7-5-8-13-20)26(21-16-18-23(19-17-21)28-4-2)27(29-24)22-14-9-6-10-15-22/h3,5-10,12-19H,1,4,11H2,2H3.
What are the key properties of 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran?
3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran has a molecular weight of 380.49 g/mol, XLogP of 7.41, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenyl)-2,4-diphenyl-5-prop-2-enylfuran is sourced from PubChem (CID 135022466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).