[(E)-2-phenylpent-3-en-2-yl]benzene

C17H18 — CID 14338227

IUPAC[(E)-2-phenylpent-3-en-2-yl]benzene
SMILESC/C=C/C(C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H18/c1-3-14-17(2,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h3-14H,1-2H3/b14-3+
InChIKeyFHLCFDOUJGUIOT-LZWSPWQCSA-N
MW222.33 g/mol
LogP4.57
Rot. Bonds3

About [(E)-2-phenylpent-3-en-2-yl]benzene

[(E)-2-phenylpent-3-en-2-yl]benzene (PubChem CID 14338227) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is [(E)-2-phenylpent-3-en-2-yl]benzene.

Molecular Properties

Compound Name[(E)-2-phenylpent-3-en-2-yl]benzene
PubChem CID14338227
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name[(E)-2-phenylpent-3-en-2-yl]benzene
SMILESC/C=C/C(C)(c1ccccc1)c1ccccc1
InChIInChI=1S/C17H18/c1-3-14-17(2,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h3-14H,1-2H3/b14-3+
InChIKeyFHLCFDOUJGUIOT-LZWSPWQCSA-N
XLogP4.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

[(Z)-2-methylpent-3-en-2-yl]benzene
CID 154027835
1,1-diphenylbut-2-enoxysilane
CID 175222851
(3,4-dimethyl-4-phenylhexa-1,5-dien-3-yl)benzene
CID 166095951
[(E,4S)-4-methylnon-2-en-4-yl]benzene
CID 101254578
2-phenylpropan-2-ylbenzene
CID 13065
CID 171375456
CID 171375456
[(E)-2,2-dimethylpent-3-enyl]benzene
CID 10487473
(1-bromo-1-phenylethyl)benzene
CID 19019197
tert-butylbenzene;2,2-dimethylpropane;methane
CID 160959011
tert-butylbenzene;molecular nitrogen
CID 146464751
tert-butylbenzene;chloromethane;ethane
CID 91149652
benzene;tert-butylbenzene;bis(2,2-dimethylpropane);ethane
CID 158670454

Frequently Asked Questions

What is the IUPAC name of [(E)-2-phenylpent-3-en-2-yl]benzene?
The IUPAC name of [(E)-2-phenylpent-3-en-2-yl]benzene (CID 14338227) is [(E)-2-phenylpent-3-en-2-yl]benzene.
What is the SMILES notation for [(E)-2-phenylpent-3-en-2-yl]benzene?
The canonical SMILES for [(E)-2-phenylpent-3-en-2-yl]benzene is C/C=C/C(C)(c1ccccc1)c1ccccc1.
What is the InChIKey of [(E)-2-phenylpent-3-en-2-yl]benzene?
The InChIKey is FHLCFDOUJGUIOT-LZWSPWQCSA-N. The full InChI is InChI=1S/C17H18/c1-3-14-17(2,15-10-6-4-7-11-15)16-12-8-5-9-13-16/h3-14H,1-2H3/b14-3+.
What are the key properties of [(E)-2-phenylpent-3-en-2-yl]benzene?
[(E)-2-phenylpent-3-en-2-yl]benzene has a molecular weight of 222.33 g/mol, XLogP of 4.57, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-phenylpent-3-en-2-yl]benzene is sourced from PubChem (CID 14338227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).