1-(4-propylcyclohexen-1-yl)pyrrolidine

C13H23N — CID 22709049

IUPAC1-(4-propylcyclohexen-1-yl)pyrrolidine
SMILESCCCC1CC=C(N2CCCC2)CC1
InChIInChI=1S/C13H23N/c1-2-5-12-6-8-13(9-7-12)14-10-3-4-11-14/h8,12H,2-7,9-11H2,1H3
InChIKeyKNYPUEGBEDBZNY-UHFFFAOYSA-N
MW193.33 g/mol
LogP3.57
Rot. Bonds3

About 1-(4-propylcyclohexen-1-yl)pyrrolidine

1-(4-propylcyclohexen-1-yl)pyrrolidine (PubChem CID 22709049) has the molecular formula C13H23N and a molecular weight of 193.33 g/mol. Its IUPAC name is 1-(4-propylcyclohexen-1-yl)pyrrolidine.

Molecular Properties

Compound Name1-(4-propylcyclohexen-1-yl)pyrrolidine
PubChem CID22709049
Molecular FormulaC13H23N
Molecular Weight193.33 g/mol
Exact Mass193.18
IUPAC Name1-(4-propylcyclohexen-1-yl)pyrrolidine
SMILESCCCC1CC=C(N2CCCC2)CC1
InChIInChI=1S/C13H23N/c1-2-5-12-6-8-13(9-7-12)14-10-3-4-11-14/h8,12H,2-7,9-11H2,1H3
InChIKeyKNYPUEGBEDBZNY-UHFFFAOYSA-N
XLogP3.57
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.33
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(4-propylcyclohexen-1-yl)pyrrolidine 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-(4-propylcyclohexen-1-yl)pyrrolidine?
The IUPAC name of 1-(4-propylcyclohexen-1-yl)pyrrolidine (CID 22709049) is 1-(4-propylcyclohexen-1-yl)pyrrolidine.
What is the SMILES notation for 1-(4-propylcyclohexen-1-yl)pyrrolidine?
The canonical SMILES for 1-(4-propylcyclohexen-1-yl)pyrrolidine is CCCC1CC=C(N2CCCC2)CC1.
What is the InChIKey of 1-(4-propylcyclohexen-1-yl)pyrrolidine?
The InChIKey is KNYPUEGBEDBZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N/c1-2-5-12-6-8-13(9-7-12)14-10-3-4-11-14/h8,12H,2-7,9-11H2,1H3.
What are the key properties of 1-(4-propylcyclohexen-1-yl)pyrrolidine?
1-(4-propylcyclohexen-1-yl)pyrrolidine has a molecular weight of 193.33 g/mol, XLogP of 3.57, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propylcyclohexen-1-yl)pyrrolidine is sourced from PubChem (CID 22709049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).