(2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one

C17H14O2 — CID 134140486

IUPAC(2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one
SMILESO=C(/C=C/C=C/c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C17H14O2/c18-16-12-10-14(11-13-16)6-4-5-9-17(19)15-7-2-1-3-8-15/h1-13,18H/b6-4+,9-5+
InChIKeyCZQGQSTXDRQRDU-REZHQCRGSA-N
MW250.30 g/mol
LogP3.84
Rot. Bonds4

About (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one

(2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one (PubChem CID 134140486) has the molecular formula C17H14O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one.

Molecular Properties

Compound Name(2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one
PubChem CID134140486
Molecular FormulaC17H14O2
Molecular Weight250.30 g/mol
Exact Mass250.10
IUPAC Name(2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one
SMILESO=C(/C=C/C=C/c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C17H14O2/c18-16-12-10-14(11-13-16)6-4-5-9-17(19)15-7-2-1-3-8-15/h1-13,18H/b6-4+,9-5+
InChIKeyCZQGQSTXDRQRDU-REZHQCRGSA-N
XLogP3.84
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

Analyze (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one 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

1,3-bis(4-hydroxyphenyl)prop-2-en-1-one;3-(4-hydroxyphenyl)-1-phenylprop-2-en-1-one
CID 67873183
(2E,4E)-5-(4-methoxyphenyl)-1-phenylpenta-2,4-dien-1-one
CID 10539553
11-(4-hydroxyphenyl)undeca-2,4,6,8,10-pentaenoic acid
CID 91104661
(2E,4Z)-1-(4-methylphenyl)-5-phenylpenta-2,4-dien-1-one
CID 92526505
(2Z,4E)-1-(4-methylphenyl)-5-phenylpenta-2,4-dien-1-one
CID 54612350
1,3-diphenylprop-2-en-1-one;5-[(E)-2-(4-hydroxyphenyl)ethenyl]benzene-1,3-diol
CID 174616800
(E)-3-[4-[(E)-2-[4-[(E)-3-oxo-3-phenylprop-1-enyl]phenyl]ethenyl]phenyl]-1-phenylprop-2-en-1-one
CID 102135410
(4E)-5-(4-azidophenyl)-1-phenylpenta-2,4-dien-1-one
CID 174058318
(2E,4E)-1-(4-anilinophenyl)-5-phenylpenta-2,4-dien-1-one
CID 171377751
4-ethenylphenol;5-phenylpenta-2,4-dienoic acid
CID 86612192
(2E,4E)-5-(4-hydroxy-3,5-dimethoxyphenyl)-1-phenylpenta-2,4-dien-1-one
CID 127042887
4-[6-(4-hydroxyphenyl)hexa-1,3,5-trienyl]phenol
CID 73020850

Frequently Asked Questions

What is the IUPAC name of (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one?
The IUPAC name of (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one (CID 134140486) is (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one.
What is the SMILES notation for (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one?
The canonical SMILES for (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one is O=C(/C=C/C=C/c1ccc(O)cc1)c1ccccc1.
What is the InChIKey of (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one?
The InChIKey is CZQGQSTXDRQRDU-REZHQCRGSA-N. The full InChI is InChI=1S/C17H14O2/c18-16-12-10-14(11-13-16)6-4-5-9-17(19)15-7-2-1-3-8-15/h1-13,18H/b6-4+,9-5+.
What are the key properties of (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one?
(2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one has a molecular weight of 250.30 g/mol, XLogP of 3.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-5-(4-hydroxyphenyl)-1-phenylpenta-2,4-dien-1-one is sourced from PubChem (CID 134140486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).