3-ethyl-1-prop-2-enylpiperidin-4-ol

C10H19NO — CID 114510881

IUPAC3-ethyl-1-prop-2-enylpiperidin-4-ol
SMILESC=CCN1CCC(O)C(CC)C1
InChIInChI=1S/C10H19NO/c1-3-6-11-7-5-10(12)9(4-2)8-11/h3,9-10,12H,1,4-8H2,2H3
InChIKeyKWCCBCSCKQTUFE-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.27
Rot. Bonds3

About 3-ethyl-1-prop-2-enylpiperidin-4-ol

3-ethyl-1-prop-2-enylpiperidin-4-ol (PubChem CID 114510881) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 3-ethyl-1-prop-2-enylpiperidin-4-ol.

Molecular Properties

Compound Name3-ethyl-1-prop-2-enylpiperidin-4-ol
PubChem CID114510881
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name3-ethyl-1-prop-2-enylpiperidin-4-ol
SMILESC=CCN1CCC(O)C(CC)C1
InChIInChI=1S/C10H19NO/c1-3-6-11-7-5-10(12)9(4-2)8-11/h3,9-10,12H,1,4-8H2,2H3
InChIKeyKWCCBCSCKQTUFE-UHFFFAOYSA-N
XLogP1.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.27
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 3-ethyl-1-prop-2-enylpiperidin-4-ol?
The IUPAC name of 3-ethyl-1-prop-2-enylpiperidin-4-ol (CID 114510881) is 3-ethyl-1-prop-2-enylpiperidin-4-ol.
What is the SMILES notation for 3-ethyl-1-prop-2-enylpiperidin-4-ol?
The canonical SMILES for 3-ethyl-1-prop-2-enylpiperidin-4-ol is C=CCN1CCC(O)C(CC)C1.
What is the InChIKey of 3-ethyl-1-prop-2-enylpiperidin-4-ol?
The InChIKey is KWCCBCSCKQTUFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-3-6-11-7-5-10(12)9(4-2)8-11/h3,9-10,12H,1,4-8H2,2H3.
What are the key properties of 3-ethyl-1-prop-2-enylpiperidin-4-ol?
3-ethyl-1-prop-2-enylpiperidin-4-ol has a molecular weight of 169.27 g/mol, XLogP of 1.27, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-prop-2-enylpiperidin-4-ol is sourced from PubChem (CID 114510881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).