1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol

C11H18O2 — CID 70441091

IUPAC1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol
SMILESC=CC(O)C1(C(O)C=C)CCCC1
InChIInChI=1S/C11H18O2/c1-3-9(12)11(10(13)4-2)7-5-6-8-11/h3-4,9-10,12-13H,1-2,5-8H2
InChIKeyUBZDAQMMICRAIP-UHFFFAOYSA-N
MW182.26 g/mol
LogP1.64
Rot. Bonds4

About 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol

1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol (PubChem CID 70441091) has the molecular formula C11H18O2 and a molecular weight of 182.26 g/mol. Its IUPAC name is 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol.

Molecular Properties

Compound Name1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol
PubChem CID70441091
Molecular FormulaC11H18O2
Molecular Weight182.26 g/mol
Exact Mass182.13
IUPAC Name1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol
SMILESC=CC(O)C1(C(O)C=C)CCCC1
InChIInChI=1S/C11H18O2/c1-3-9(12)11(10(13)4-2)7-5-6-8-11/h3-4,9-10,12-13H,1-2,5-8H2
InChIKeyUBZDAQMMICRAIP-UHFFFAOYSA-N
XLogP1.64
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.26
LogP ≤ 51.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol?
The IUPAC name of 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol (CID 70441091) is 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol.
What is the SMILES notation for 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol?
The canonical SMILES for 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol is C=CC(O)C1(C(O)C=C)CCCC1.
What is the InChIKey of 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol?
The InChIKey is UBZDAQMMICRAIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18O2/c1-3-9(12)11(10(13)4-2)7-5-6-8-11/h3-4,9-10,12-13H,1-2,5-8H2.
What are the key properties of 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol?
1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol has a molecular weight of 182.26 g/mol, XLogP of 1.64, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-hydroxyprop-2-enyl)cyclopentyl]prop-2-en-1-ol is sourced from PubChem (CID 70441091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).