1-ethenyl-3-(1-methylcyclopentyl)oxybenzene

C14H18O — CID 18762125

IUPAC1-ethenyl-3-(1-methylcyclopentyl)oxybenzene
SMILESC=Cc1cccc(OC2(C)CCCC2)c1
InChIInChI=1S/C14H18O/c1-3-12-7-6-8-13(11-12)15-14(2)9-4-5-10-14/h3,6-8,11H,1,4-5,9-10H2,2H3
InChIKeyBHYVMOKTUSNJSE-UHFFFAOYSA-N
MW202.30 g/mol
LogP4.04
Rot. Bonds3

About 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene

1-ethenyl-3-(1-methylcyclopentyl)oxybenzene (PubChem CID 18762125) has the molecular formula C14H18O and a molecular weight of 202.30 g/mol. Its IUPAC name is 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene.

Molecular Properties

Compound Name1-ethenyl-3-(1-methylcyclopentyl)oxybenzene
PubChem CID18762125
Molecular FormulaC14H18O
Molecular Weight202.30 g/mol
Exact Mass202.14
IUPAC Name1-ethenyl-3-(1-methylcyclopentyl)oxybenzene
SMILESC=Cc1cccc(OC2(C)CCCC2)c1
InChIInChI=1S/C14H18O/c1-3-12-7-6-8-13(11-12)15-14(2)9-4-5-10-14/h3,6-8,11H,1,4-5,9-10H2,2H3
InChIKeyBHYVMOKTUSNJSE-UHFFFAOYSA-N
XLogP4.04
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 ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene?
The IUPAC name of 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene (CID 18762125) is 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene.
What is the SMILES notation for 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene?
The canonical SMILES for 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene is C=Cc1cccc(OC2(C)CCCC2)c1.
What is the InChIKey of 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene?
The InChIKey is BHYVMOKTUSNJSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O/c1-3-12-7-6-8-13(11-12)15-14(2)9-4-5-10-14/h3,6-8,11H,1,4-5,9-10H2,2H3.
What are the key properties of 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene?
1-ethenyl-3-(1-methylcyclopentyl)oxybenzene has a molecular weight of 202.30 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3-(1-methylcyclopentyl)oxybenzene is sourced from PubChem (CID 18762125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).