[(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene

C15H18 — CID 140946017

IUPAC[(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene
SMILESC/C(=C\c1ccccc1)[C@H]1C=CCCC1
InChIInChI=1S/C15H18/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2,4-6,8-10,12,15H,3,7,11H2,1H3/b13-12+/t15-/m0/s1
InChIKeyWRJNHPQXTBNODY-LHNRBYRGSA-N
MW198.31 g/mol
LogP4.45
Rot. Bonds2

About [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene

[(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene (PubChem CID 140946017) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene.

Molecular Properties

Compound Name[(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene
PubChem CID140946017
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name[(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene
SMILESC/C(=C\c1ccccc1)[C@H]1C=CCCC1
InChIInChI=1S/C15H18/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2,4-6,8-10,12,15H,3,7,11H2,1H3/b13-12+/t15-/m0/s1
InChIKeyWRJNHPQXTBNODY-LHNRBYRGSA-N
XLogP4.45
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene?
The IUPAC name of [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene (CID 140946017) is [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene.
What is the SMILES notation for [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene?
The canonical SMILES for [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene is C/C(=C\c1ccccc1)[C@H]1C=CCCC1.
What is the InChIKey of [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene?
The InChIKey is WRJNHPQXTBNODY-LHNRBYRGSA-N. The full InChI is InChI=1S/C15H18/c1-13(15-10-6-3-7-11-15)12-14-8-4-2-5-9-14/h2,4-6,8-10,12,15H,3,7,11H2,1H3/b13-12+/t15-/m0/s1.
What are the key properties of [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene?
[(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene has a molecular weight of 198.31 g/mol, XLogP of 4.45, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-[(1R)-cyclohex-2-en-1-yl]prop-1-enyl]benzene is sourced from PubChem (CID 140946017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).