2-(1-methylcyclopentyl)oxyethenylbenzene

C14H18O — CID 69415845

IUPAC2-(1-methylcyclopentyl)oxyethenylbenzene
SMILESCC1(OC=Cc2ccccc2)CCCC1
InChIInChI=1S/C14H18O/c1-14(10-5-6-11-14)15-12-9-13-7-3-2-4-8-13/h2-4,7-9,12H,5-6,10-11H2,1H3
InChIKeySXBMPAFKAJVIJC-UHFFFAOYSA-N
MW202.30 g/mol
LogP4.01
Rot. Bonds3

About 2-(1-methylcyclopentyl)oxyethenylbenzene

2-(1-methylcyclopentyl)oxyethenylbenzene (PubChem CID 69415845) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 2-(1-methylcyclopentyl)oxyethenylbenzene.

Molecular Properties

Compound Name2-(1-methylcyclopentyl)oxyethenylbenzene
PubChem CID69415845
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name2-(1-methylcyclopentyl)oxyethenylbenzene
SMILESCC1(OC=Cc2ccccc2)CCCC1
InChIInChI=1S/C14H18O/c1-14(10-5-6-11-14)15-12-9-13-7-3-2-4-8-13/h2-4,7-9,12H,5-6,10-11H2,1H3
InChIKeySXBMPAFKAJVIJC-UHFFFAOYSA-N
XLogP4.01
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methylcyclopentyl)oxyethenylbenzene?
The IUPAC name of 2-(1-methylcyclopentyl)oxyethenylbenzene (CID 69415845) is 2-(1-methylcyclopentyl)oxyethenylbenzene.
What is the SMILES notation for 2-(1-methylcyclopentyl)oxyethenylbenzene?
The canonical SMILES for 2-(1-methylcyclopentyl)oxyethenylbenzene is CC1(OC=Cc2ccccc2)CCCC1.
What is the InChIKey of 2-(1-methylcyclopentyl)oxyethenylbenzene?
The InChIKey is SXBMPAFKAJVIJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-14(10-5-6-11-14)15-12-9-13-7-3-2-4-8-13/h2-4,7-9,12H,5-6,10-11H2,1H3.
What are the key properties of 2-(1-methylcyclopentyl)oxyethenylbenzene?
2-(1-methylcyclopentyl)oxyethenylbenzene has a molecular weight of 202.30 g/mol, XLogP of 4.01, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methylcyclopentyl)oxyethenylbenzene is sourced from PubChem (CID 69415845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).