1,2-bis(prop-1-enoxy)cyclopentane

C11H18O2 — CID 54340288

IUPAC1,2-bis(prop-1-enoxy)cyclopentane
SMILESCC=COC1CCCC1OC=CC
InChIInChI=1S/C11H18O2/c1-3-8-12-10-6-5-7-11(10)13-9-4-2/h3-4,8-11H,5-7H2,1-2H3
InChIKeyTYLGAXKJTCOTKQ-UHFFFAOYSA-N
MW182.26 g/mol
LogP3.01
Rot. Bonds4

About 1,2-bis(prop-1-enoxy)cyclopentane

1,2-bis(prop-1-enoxy)cyclopentane (PubChem CID 54340288) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 1,2-bis(prop-1-enoxy)cyclopentane.

Molecular Properties

Compound Name1,2-bis(prop-1-enoxy)cyclopentane
PubChem CID54340288
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name1,2-bis(prop-1-enoxy)cyclopentane
SMILESCC=COC1CCCC1OC=CC
InChIInChI=1S/C11H18O2/c1-3-8-12-10-6-5-7-11(10)13-9-4-2/h3-4,8-11H,5-7H2,1-2H3
InChIKeyTYLGAXKJTCOTKQ-UHFFFAOYSA-N
XLogP3.01
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 1,2-bis(prop-1-enoxy)cyclopentane?
The IUPAC name of 1,2-bis(prop-1-enoxy)cyclopentane (CID 54340288) is 1,2-bis(prop-1-enoxy)cyclopentane.
What is the SMILES notation for 1,2-bis(prop-1-enoxy)cyclopentane?
The canonical SMILES for 1,2-bis(prop-1-enoxy)cyclopentane is CC=COC1CCCC1OC=CC.
What is the InChIKey of 1,2-bis(prop-1-enoxy)cyclopentane?
The InChIKey is TYLGAXKJTCOTKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-3-8-12-10-6-5-7-11(10)13-9-4-2/h3-4,8-11H,5-7H2,1-2H3.
What are the key properties of 1,2-bis(prop-1-enoxy)cyclopentane?
1,2-bis(prop-1-enoxy)cyclopentane has a molecular weight of 182.26 g/mol, XLogP of 3.01, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(prop-1-enoxy)cyclopentane is sourced from PubChem (CID 54340288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).