1-ethenyl-3-propylpyrrolidine

C9H17N — CID 91360091

IUPAC1-ethenyl-3-propylpyrrolidine
SMILESC=CN1CCC(CCC)C1
InChIInChI=1S/C9H17N/c1-3-5-9-6-7-10(4-2)8-9/h4,9H,2-3,5-8H2,1H3
InChIKeyNHICIIRFDUWENU-UHFFFAOYSA-N
MW139.24 g/mol
LogP2.25
Rot. Bonds3

About 1-ethenyl-3-propylpyrrolidine

1-ethenyl-3-propylpyrrolidine (PubChem CID 91360091) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 1-ethenyl-3-propylpyrrolidine.

Molecular Properties

Compound Name1-ethenyl-3-propylpyrrolidine
PubChem CID91360091
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name1-ethenyl-3-propylpyrrolidine
SMILESC=CN1CCC(CCC)C1
InChIInChI=1S/C9H17N/c1-3-5-9-6-7-10(4-2)8-9/h4,9H,2-3,5-8H2,1H3
InChIKeyNHICIIRFDUWENU-UHFFFAOYSA-N
XLogP2.25
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-ethenyl-3-propylpyrrolidine 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-ethenyl-3-propylpyrrolidine?
The IUPAC name of 1-ethenyl-3-propylpyrrolidine (CID 91360091) is 1-ethenyl-3-propylpyrrolidine.
What is the SMILES notation for 1-ethenyl-3-propylpyrrolidine?
The canonical SMILES for 1-ethenyl-3-propylpyrrolidine is C=CN1CCC(CCC)C1.
What is the InChIKey of 1-ethenyl-3-propylpyrrolidine?
The InChIKey is NHICIIRFDUWENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-3-5-9-6-7-10(4-2)8-9/h4,9H,2-3,5-8H2,1H3.
What are the key properties of 1-ethenyl-3-propylpyrrolidine?
1-ethenyl-3-propylpyrrolidine has a molecular weight of 139.24 g/mol, XLogP of 2.25, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-3-propylpyrrolidine is sourced from PubChem (CID 91360091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).