1-(4-prop-2-enoxycyclohexyl)ethanol

C11H20O2 — CID 174378601

IUPAC1-(4-prop-2-enoxycyclohexyl)ethanol
SMILESC=CCOC1CCC(C(C)O)CC1
InChIInChI=1S/C11H20O2/c1-3-8-13-11-6-4-10(5-7-11)9(2)12/h3,9-12H,1,4-8H2,2H3
InChIKeyPFNZXGDWXPBDTE-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.13
Rot. Bonds4

About 1-(4-prop-2-enoxycyclohexyl)ethanol

1-(4-prop-2-enoxycyclohexyl)ethanol (PubChem CID 174378601) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-(4-prop-2-enoxycyclohexyl)ethanol.

Molecular Properties

Compound Name1-(4-prop-2-enoxycyclohexyl)ethanol
PubChem CID174378601
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-(4-prop-2-enoxycyclohexyl)ethanol
SMILESC=CCOC1CCC(C(C)O)CC1
InChIInChI=1S/C11H20O2/c1-3-8-13-11-6-4-10(5-7-11)9(2)12/h3,9-12H,1,4-8H2,2H3
InChIKeyPFNZXGDWXPBDTE-UHFFFAOYSA-N
XLogP2.13
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.13
H-Bond Donors ≤ 51
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-(4-prop-2-enoxycyclohexyl)ethanol?
The IUPAC name of 1-(4-prop-2-enoxycyclohexyl)ethanol (CID 174378601) is 1-(4-prop-2-enoxycyclohexyl)ethanol.
What is the SMILES notation for 1-(4-prop-2-enoxycyclohexyl)ethanol?
The canonical SMILES for 1-(4-prop-2-enoxycyclohexyl)ethanol is C=CCOC1CCC(C(C)O)CC1.
What is the InChIKey of 1-(4-prop-2-enoxycyclohexyl)ethanol?
The InChIKey is PFNZXGDWXPBDTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-8-13-11-6-4-10(5-7-11)9(2)12/h3,9-12H,1,4-8H2,2H3.
What are the key properties of 1-(4-prop-2-enoxycyclohexyl)ethanol?
1-(4-prop-2-enoxycyclohexyl)ethanol has a molecular weight of 184.28 g/mol, XLogP of 2.13, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-prop-2-enoxycyclohexyl)ethanol is sourced from PubChem (CID 174378601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).