(1-prop-2-enylpyrrolidin-3-yl)methanol

C8H15NO — CID 25219526

IUPAC(1-prop-2-enylpyrrolidin-3-yl)methanol
SMILESC=CCN1CCC(CO)C1
InChIInChI=1S/C8H15NO/c1-2-4-9-5-3-8(6-9)7-10/h2,8,10H,1,3-7H2
InChIKeyYBRJLPHATQNWJL-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.49
Rot. Bonds3

About (1-prop-2-enylpyrrolidin-3-yl)methanol

(1-prop-2-enylpyrrolidin-3-yl)methanol (PubChem CID 25219526) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is (1-prop-2-enylpyrrolidin-3-yl)methanol.

Molecular Properties

Compound Name(1-prop-2-enylpyrrolidin-3-yl)methanol
PubChem CID25219526
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name(1-prop-2-enylpyrrolidin-3-yl)methanol
SMILESC=CCN1CCC(CO)C1
InChIInChI=1S/C8H15NO/c1-2-4-9-5-3-8(6-9)7-10/h2,8,10H,1,3-7H2
InChIKeyYBRJLPHATQNWJL-UHFFFAOYSA-N
XLogP0.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze (1-prop-2-enylpyrrolidin-3-yl)methanol 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 (1-prop-2-enylpyrrolidin-3-yl)methanol?
The IUPAC name of (1-prop-2-enylpyrrolidin-3-yl)methanol (CID 25219526) is (1-prop-2-enylpyrrolidin-3-yl)methanol.
What is the SMILES notation for (1-prop-2-enylpyrrolidin-3-yl)methanol?
The canonical SMILES for (1-prop-2-enylpyrrolidin-3-yl)methanol is C=CCN1CCC(CO)C1.
What is the InChIKey of (1-prop-2-enylpyrrolidin-3-yl)methanol?
The InChIKey is YBRJLPHATQNWJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-2-4-9-5-3-8(6-9)7-10/h2,8,10H,1,3-7H2.
What are the key properties of (1-prop-2-enylpyrrolidin-3-yl)methanol?
(1-prop-2-enylpyrrolidin-3-yl)methanol has a molecular weight of 141.21 g/mol, XLogP of 0.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1-prop-2-enylpyrrolidin-3-yl)methanol is sourced from PubChem (CID 25219526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).