[(E,2R)-5-phenylpent-4-en-2-yl]benzene

C17H18 — CID 102293607

IUPAC[(E,2R)-5-phenylpent-4-en-2-yl]benzene
SMILESC[C@H](C/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C17H18/c1-15(17-13-6-3-7-14-17)9-8-12-16-10-4-2-5-11-16/h2-8,10-15H,9H2,1H3/b12-8+/t15-/m1/s1
InChIKeyKKSPSCQACIDIMM-INDWDQIESA-N
MW222.33 g/mol
LogP4.89
Rot. Bonds4

About [(E,2R)-5-phenylpent-4-en-2-yl]benzene

[(E,2R)-5-phenylpent-4-en-2-yl]benzene (PubChem CID 102293607) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is [(E,2R)-5-phenylpent-4-en-2-yl]benzene.

Molecular Properties

Compound Name[(E,2R)-5-phenylpent-4-en-2-yl]benzene
PubChem CID102293607
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name[(E,2R)-5-phenylpent-4-en-2-yl]benzene
SMILESC[C@H](C/C=C/c1ccccc1)c1ccccc1
InChIInChI=1S/C17H18/c1-15(17-13-6-3-7-14-17)9-8-12-16-10-4-2-5-11-16/h2-8,10-15H,9H2,1H3/b12-8+/t15-/m1/s1
InChIKeyKKSPSCQACIDIMM-INDWDQIESA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1-methylsulfanyl-4-[(E,2S)-5-phenylpent-4-en-2-yl]benzene
CID 135060945
4-chloropent-1-enylbenzene
CID 66808272
(E)-5-phenylpent-4-en-2-amine
CID 55254237
[(E)-1-chloro-4-phenylbut-3-enyl]benzene
CID 13252853
N-methyl-1,4-diphenylbut-3-en-1-amine
CID 54080999
(3R)-3-phenylbutanal
CID 10877278
(Z)-3-phenyl-N-[(1S)-1-phenylethyl]prop-2-en-1-amine
CID 15311491
4,5-dimethylhepta-1,5-dienylbenzene
CID 123392853
(E)-3-phenyl-N-[(1R)-1-phenylethyl]prop-2-en-1-amine
CID 7202013
(E,3R)-2-methyl-6-phenyl-N-propan-2-ylhex-5-en-3-amine
CID 59058683
[(1E)-5-phenylpenta-1,4-dienyl]benzene
CID 91021368
benzene;but-1-enylbenzene
CID 157481332

Frequently Asked Questions

What is the IUPAC name of [(E,2R)-5-phenylpent-4-en-2-yl]benzene?
The IUPAC name of [(E,2R)-5-phenylpent-4-en-2-yl]benzene (CID 102293607) is [(E,2R)-5-phenylpent-4-en-2-yl]benzene.
What is the SMILES notation for [(E,2R)-5-phenylpent-4-en-2-yl]benzene?
The canonical SMILES for [(E,2R)-5-phenylpent-4-en-2-yl]benzene is C[C@H](C/C=C/c1ccccc1)c1ccccc1.
What is the InChIKey of [(E,2R)-5-phenylpent-4-en-2-yl]benzene?
The InChIKey is KKSPSCQACIDIMM-INDWDQIESA-N. The full InChI is InChI=1S/C17H18/c1-15(17-13-6-3-7-14-17)9-8-12-16-10-4-2-5-11-16/h2-8,10-15H,9H2,1H3/b12-8+/t15-/m1/s1.
What are the key properties of [(E,2R)-5-phenylpent-4-en-2-yl]benzene?
[(E,2R)-5-phenylpent-4-en-2-yl]benzene has a molecular weight of 222.33 g/mol, XLogP of 4.89, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E,2R)-5-phenylpent-4-en-2-yl]benzene is sourced from PubChem (CID 102293607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).