4-prop-2-enyl-1-propylpiperidin-4-ol

C11H21NO — CID 79733591

IUPAC4-prop-2-enyl-1-propylpiperidin-4-ol
SMILESC=CCC1(O)CCN(CCC)CC1
InChIInChI=1S/C11H21NO/c1-3-5-11(13)6-9-12(8-4-2)10-7-11/h3,13H,1,4-10H2,2H3
InChIKeyKRPAQMININQUDS-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.80
Rot. Bonds4

About 4-prop-2-enyl-1-propylpiperidin-4-ol

4-prop-2-enyl-1-propylpiperidin-4-ol (PubChem CID 79733591) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 4-prop-2-enyl-1-propylpiperidin-4-ol.

Molecular Properties

Compound Name4-prop-2-enyl-1-propylpiperidin-4-ol
PubChem CID79733591
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name4-prop-2-enyl-1-propylpiperidin-4-ol
SMILESC=CCC1(O)CCN(CCC)CC1
InChIInChI=1S/C11H21NO/c1-3-5-11(13)6-9-12(8-4-2)10-7-11/h3,13H,1,4-10H2,2H3
InChIKeyKRPAQMININQUDS-UHFFFAOYSA-N
XLogP1.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.80
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 4-prop-2-enyl-1-propylpiperidin-4-ol?
The IUPAC name of 4-prop-2-enyl-1-propylpiperidin-4-ol (CID 79733591) is 4-prop-2-enyl-1-propylpiperidin-4-ol.
What is the SMILES notation for 4-prop-2-enyl-1-propylpiperidin-4-ol?
The canonical SMILES for 4-prop-2-enyl-1-propylpiperidin-4-ol is C=CCC1(O)CCN(CCC)CC1.
What is the InChIKey of 4-prop-2-enyl-1-propylpiperidin-4-ol?
The InChIKey is KRPAQMININQUDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-3-5-11(13)6-9-12(8-4-2)10-7-11/h3,13H,1,4-10H2,2H3.
What are the key properties of 4-prop-2-enyl-1-propylpiperidin-4-ol?
4-prop-2-enyl-1-propylpiperidin-4-ol has a molecular weight of 183.29 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-prop-2-enyl-1-propylpiperidin-4-ol is sourced from PubChem (CID 79733591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).