[(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene

C18H20 — CID 6432959

IUPAC[(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene
SMILESCC/C(C)=C(\Cc1ccccc1)c1ccccc1
InChIInChI=1S/C18H20/c1-3-15(2)18(17-12-8-5-9-13-17)14-16-10-6-4-7-11-16/h4-13H,3,14H2,1-2H3/b18-15+
InChIKeyXYSGYGLRXOWMPL-OBGWFSINSA-N
MW236.36 g/mol
LogP5.11
Rot. Bonds4

About [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene

[(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene (PubChem CID 6432959) has the molecular formula C18H20 and a molecular weight of 236.36 g/mol. Its IUPAC name is [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene.

Molecular Properties

Compound Name[(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene
PubChem CID6432959
Molecular FormulaC18H20
Molecular Weight236.36 g/mol
Exact Mass236.16
IUPAC Name[(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene
SMILESCC/C(C)=C(\Cc1ccccc1)c1ccccc1
InChIInChI=1S/C18H20/c1-3-15(2)18(17-12-8-5-9-13-17)14-16-10-6-4-7-11-16/h4-13H,3,14H2,1-2H3/b18-15+
InChIKeyXYSGYGLRXOWMPL-OBGWFSINSA-N
XLogP5.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.36
LogP ≤ 55.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

[(Z)-4-methylhex-3-en-3-yl]benzene
CID 142361639
ethane-1,2-diol;[(E)-1,3,4-triphenylbut-2-en-2-yl]benzene
CID 70616201
(E)-2-methyl-3-phenylpent-2-en-1-ol
CID 134126530
5-methyl-1,4-diphenylhex-4-en-2-one
CID 102590808
2-ethyl-3-methyl-4-phenylbut-2-enoic acid
CID 151965937
2-[(E)-1,3-diphenylpent-2-en-2-yl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
CID 46220785
2-methylidenebutylbenzene
CID 10964655
[(E)-1-phenylbut-2-en-2-yl]benzene
CID 6152777
benzene;1-phenylpropan-2-one
CID 21430852
1-phenylpropane-2-thione
CID 19915653
2-nitrosopent-2-en-3-ylbenzene
CID 90886077
4-phenylhex-3-en-3-amine
CID 140615450

Frequently Asked Questions

What is the IUPAC name of [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene?
The IUPAC name of [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene (CID 6432959) is [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene.
What is the SMILES notation for [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene?
The canonical SMILES for [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene is CC/C(C)=C(\Cc1ccccc1)c1ccccc1.
What is the InChIKey of [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene?
The InChIKey is XYSGYGLRXOWMPL-OBGWFSINSA-N. The full InChI is InChI=1S/C18H20/c1-3-15(2)18(17-12-8-5-9-13-17)14-16-10-6-4-7-11-16/h4-13H,3,14H2,1-2H3/b18-15+.
What are the key properties of [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene?
[(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene has a molecular weight of 236.36 g/mol, XLogP of 5.11, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3-methyl-1-phenylpent-2-en-2-yl]benzene is sourced from PubChem (CID 6432959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).