3-pent-4-enoxycyclohexan-1-ol

C11H20O2 — CID 14818314

IUPAC3-pent-4-enoxycyclohexan-1-ol
SMILESC=CCCCOC1CCCC(O)C1
InChIInChI=1S/C11H20O2/c1-2-3-4-8-13-11-7-5-6-10(12)9-11/h2,10-12H,1,3-9H2
InChIKeyUZXGZNCUEJJPQD-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.27
Rot. Bonds5

About 3-pent-4-enoxycyclohexan-1-ol

3-pent-4-enoxycyclohexan-1-ol (PubChem CID 14818314) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-pent-4-enoxycyclohexan-1-ol.

Molecular Properties

Compound Name3-pent-4-enoxycyclohexan-1-ol
PubChem CID14818314
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name3-pent-4-enoxycyclohexan-1-ol
SMILESC=CCCCOC1CCCC(O)C1
InChIInChI=1S/C11H20O2/c1-2-3-4-8-13-11-7-5-6-10(12)9-11/h2,10-12H,1,3-9H2
InChIKeyUZXGZNCUEJJPQD-UHFFFAOYSA-N
XLogP2.27
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-pent-4-enoxycyclohexan-1-ol?
The IUPAC name of 3-pent-4-enoxycyclohexan-1-ol (CID 14818314) is 3-pent-4-enoxycyclohexan-1-ol.
What is the SMILES notation for 3-pent-4-enoxycyclohexan-1-ol?
The canonical SMILES for 3-pent-4-enoxycyclohexan-1-ol is C=CCCCOC1CCCC(O)C1.
What is the InChIKey of 3-pent-4-enoxycyclohexan-1-ol?
The InChIKey is UZXGZNCUEJJPQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-2-3-4-8-13-11-7-5-6-10(12)9-11/h2,10-12H,1,3-9H2.
What are the key properties of 3-pent-4-enoxycyclohexan-1-ol?
3-pent-4-enoxycyclohexan-1-ol has a molecular weight of 184.28 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pent-4-enoxycyclohexan-1-ol is sourced from PubChem (CID 14818314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).