3-ethenylpyrrolidin-3-ol

C6H11NO — CID 65416048

IUPAC3-ethenylpyrrolidin-3-ol
SMILESC=CC1(O)CCNC1
InChIInChI=1S/C6H11NO/c1-2-6(8)3-4-7-5-6/h2,7-8H,1,3-5H2
InChIKeyUNHSJMFKUVVKAW-UHFFFAOYSA-N
MW113.16 g/mol
LogP-0.10
Rot. Bonds1

About 3-ethenylpyrrolidin-3-ol

3-ethenylpyrrolidin-3-ol (PubChem CID 65416048) has the molecular formula C6H11NO and a molecular weight of 113.16 g/mol. Its IUPAC name is 3-ethenylpyrrolidin-3-ol.

Molecular Properties

Compound Name3-ethenylpyrrolidin-3-ol
PubChem CID65416048
Molecular FormulaC6H11NO
Molecular Weight113.16 g/mol
Exact Mass113.08
IUPAC Name3-ethenylpyrrolidin-3-ol
SMILESC=CC1(O)CCNC1
InChIInChI=1S/C6H11NO/c1-2-6(8)3-4-7-5-6/h2,7-8H,1,3-5H2
InChIKeyUNHSJMFKUVVKAW-UHFFFAOYSA-N
XLogP-0.10
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.16
LogP ≤ 5-0.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3-ethenylpyrrolidin-3-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-ethenylpyrrolidin-3-ol?
The IUPAC name of 3-ethenylpyrrolidin-3-ol (CID 65416048) is 3-ethenylpyrrolidin-3-ol.
What is the SMILES notation for 3-ethenylpyrrolidin-3-ol?
The canonical SMILES for 3-ethenylpyrrolidin-3-ol is C=CC1(O)CCNC1.
What is the InChIKey of 3-ethenylpyrrolidin-3-ol?
The InChIKey is UNHSJMFKUVVKAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO/c1-2-6(8)3-4-7-5-6/h2,7-8H,1,3-5H2.
What are the key properties of 3-ethenylpyrrolidin-3-ol?
3-ethenylpyrrolidin-3-ol has a molecular weight of 113.16 g/mol, XLogP of -0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethenylpyrrolidin-3-ol is sourced from PubChem (CID 65416048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).