[(3R)-3-phenylpent-4-enyl]benzene

C17H18 — CID 134979381

IUPAC[(3R)-3-phenylpent-4-enyl]benzene
SMILESC=C[C@@H](CCc1ccccc1)c1ccccc1
InChIInChI=1S/C17H18/c1-2-16(17-11-7-4-8-12-17)14-13-15-9-5-3-6-10-15/h2-12,16H,1,13-14H2/t16-/m0/s1
InChIKeyCNHSYMXTPGADKW-INIZCTEOSA-N
MW222.33 g/mol
LogP4.59
Rot. Bonds5

About [(3R)-3-phenylpent-4-enyl]benzene

[(3R)-3-phenylpent-4-enyl]benzene (PubChem CID 134979381) has the molecular formula C17H18 and a molecular weight of 222.33 g/mol. Its IUPAC name is [(3R)-3-phenylpent-4-enyl]benzene.

Molecular Properties

Compound Name[(3R)-3-phenylpent-4-enyl]benzene
PubChem CID134979381
Molecular FormulaC17H18
Molecular Weight222.33 g/mol
Exact Mass222.14
IUPAC Name[(3R)-3-phenylpent-4-enyl]benzene
SMILESC=C[C@@H](CCc1ccccc1)c1ccccc1
InChIInChI=1S/C17H18/c1-2-16(17-11-7-4-8-12-17)14-13-15-9-5-3-6-10-15/h2-12,16H,1,13-14H2/t16-/m0/s1
InChIKeyCNHSYMXTPGADKW-INIZCTEOSA-N
XLogP4.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 54.59
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

1-fluoro-4-[(3R)-5-phenylpent-1-en-3-yl]benzene
CID 134992008
(3S)-4-methyl-1-phenylhex-5-en-3-ol
CID 177392866
(3S)-N-methyl-3-phenylpent-4-en-1-amine
CID 143676843
(4S)-4-methyl-1-phenylhex-5-en-3-ol
CID 12938739
2-(3-phenylpent-4-enoxy)prop-2-enylbenzene
CID 134879445
1-[(3S)-5-phenylpent-1-en-3-yl]isoquinoline
CID 162411621
2-phenylbut-3-en-1-amine;hydrochloride
CID 23037991
4-phenylhex-5-enoate
CID 140706037
6-phenyloct-7-enoic acid
CID 118941596
2-(2-phenylethyl)but-3-enenitrile
CID 172991765
(3R)-N-methyl-5-phenylpent-1-en-3-amine
CID 124509710
(1R)-1,3-diphenylpropan-1-ol
CID 11845542

Frequently Asked Questions

What is the IUPAC name of [(3R)-3-phenylpent-4-enyl]benzene?
The IUPAC name of [(3R)-3-phenylpent-4-enyl]benzene (CID 134979381) is [(3R)-3-phenylpent-4-enyl]benzene.
What is the SMILES notation for [(3R)-3-phenylpent-4-enyl]benzene?
The canonical SMILES for [(3R)-3-phenylpent-4-enyl]benzene is C=C[C@@H](CCc1ccccc1)c1ccccc1.
What is the InChIKey of [(3R)-3-phenylpent-4-enyl]benzene?
The InChIKey is CNHSYMXTPGADKW-INIZCTEOSA-N. The full InChI is InChI=1S/C17H18/c1-2-16(17-11-7-4-8-12-17)14-13-15-9-5-3-6-10-15/h2-12,16H,1,13-14H2/t16-/m0/s1.
What are the key properties of [(3R)-3-phenylpent-4-enyl]benzene?
[(3R)-3-phenylpent-4-enyl]benzene has a molecular weight of 222.33 g/mol, XLogP of 4.59, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-phenylpent-4-enyl]benzene is sourced from PubChem (CID 134979381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).