(1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol

C17H16O — CID 12544085

IUPAC(1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol
SMILESOC(/C=C/c1ccccc1)/C=C/c1ccccc1
InChIInChI=1S/C17H16O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-14,17-18H/b13-11+,14-12+
InChIKeyHRTODTVBDNRDME-PHEQNACWSA-N
MW236.31 g/mol
LogP3.77
Rot. Bonds4

About (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol

(1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol (PubChem CID 12544085) has the molecular formula C17H16O and a molecular weight of 236.31 g/mol. Its IUPAC name is (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol.

Molecular Properties

Compound Name(1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol
PubChem CID12544085
Molecular FormulaC17H16O
Molecular Weight236.31 g/mol
Exact Mass236.12
IUPAC Name(1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol
SMILESOC(/C=C/c1ccccc1)/C=C/c1ccccc1
InChIInChI=1S/C17H16O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-14,17-18H/b13-11+,14-12+
InChIKeyHRTODTVBDNRDME-PHEQNACWSA-N
XLogP3.77
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol?
The IUPAC name of (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol (CID 12544085) is (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol.
What is the SMILES notation for (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol?
The canonical SMILES for (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol is OC(/C=C/c1ccccc1)/C=C/c1ccccc1.
What is the InChIKey of (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol?
The InChIKey is HRTODTVBDNRDME-PHEQNACWSA-N. The full InChI is InChI=1S/C17H16O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-14,17-18H/b13-11+,14-12+.
What are the key properties of (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol?
(1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol has a molecular weight of 236.31 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1E,4E)-1,5-diphenylpenta-1,4-dien-3-ol is sourced from PubChem (CID 12544085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).