2-[3-(5-phenylpent-1-enyl)phenyl]ethanol

C19H22O — CID 54163257

IUPAC2-[3-(5-phenylpent-1-enyl)phenyl]ethanol
SMILESOCCc1cccc(C=CCCCc2ccccc2)c1
InChIInChI=1S/C19H22O/c20-15-14-19-13-7-12-18(16-19)11-6-2-5-10-17-8-3-1-4-9-17/h1,3-4,6-9,11-13,16,20H,2,5,10,14-15H2
InChIKeyOPWWQDCVQUGUNK-UHFFFAOYSA-N
MW266.38 g/mol
LogP4.26
Rot. Bonds7

About 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol

2-[3-(5-phenylpent-1-enyl)phenyl]ethanol (PubChem CID 54163257) has the molecular formula C19H22O and a molecular weight of 266.38 g/mol. Its IUPAC name is 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol.

Molecular Properties

Compound Name2-[3-(5-phenylpent-1-enyl)phenyl]ethanol
PubChem CID54163257
Molecular FormulaC19H22O
Molecular Weight266.38 g/mol
Exact Mass266.17
IUPAC Name2-[3-(5-phenylpent-1-enyl)phenyl]ethanol
SMILESOCCc1cccc(C=CCCCc2ccccc2)c1
InChIInChI=1S/C19H22O/c20-15-14-19-13-7-12-18(16-19)11-6-2-5-10-17-8-3-1-4-9-17/h1,3-4,6-9,11-13,16,20H,2,5,10,14-15H2
InChIKeyOPWWQDCVQUGUNK-UHFFFAOYSA-N
XLogP4.26
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[3-(4-aminobut-1-enyl)phenyl]ethanol
CID 170486870
2-[3-(5-phenylpentyl)phenyl]ethanol
CID 19755656
N-[3-[3-(2-hydroxyethyl)phenyl]prop-2-enyl]acetamide
CID 169465370
1-methyl-3-[(E)-4-phenylbut-1-enyl]benzene
CID 102140920
[3-[(E)-oct-1-enyl]phenyl]methanol
CID 11298937
(E)-7-(3-benzylphenyl)hept-6-enoic acid
CID 18987223
(E)-9-phenylnon-8-en-1-ol
CID 10489025
[(E)-6-[3-[4-[4-(prop-2-enoyloxymethyl)phenyl]butyl]phenyl]hex-5-enyl] prop-2-enoate
CID 138663179
formaldehyde;2-phenylethanol
CID 143785167
2-[(E)-5-phenylpent-1-enyl]pyridine
CID 132566221
3-[3-(3-hydroxyprop-1-enyl)phenyl]propanoic acid
CID 169453778
[(E)-6-[3-[(E)-3-oxo-3-phenylmethoxyprop-1-enyl]phenyl]hex-5-enyl] (E)-3-[3-(4-prop-2-enoyloxybutyl)phenyl]prop-2-enoate
CID 166678332

Frequently Asked Questions

What is the IUPAC name of 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol?
The IUPAC name of 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol (CID 54163257) is 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol.
What is the SMILES notation for 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol?
The canonical SMILES for 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol is OCCc1cccc(C=CCCCc2ccccc2)c1.
What is the InChIKey of 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol?
The InChIKey is OPWWQDCVQUGUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O/c20-15-14-19-13-7-12-18(16-19)11-6-2-5-10-17-8-3-1-4-9-17/h1,3-4,6-9,11-13,16,20H,2,5,10,14-15H2.
What are the key properties of 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol?
2-[3-(5-phenylpent-1-enyl)phenyl]ethanol has a molecular weight of 266.38 g/mol, XLogP of 4.26, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(5-phenylpent-1-enyl)phenyl]ethanol is sourced from PubChem (CID 54163257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).