4-cyclopropyl-4-pyrrolidin-1-ylpiperidine

C12H22N2 — CID 125453347

IUPAC4-cyclopropyl-4-pyrrolidin-1-ylpiperidine
SMILESC1CCN(C2(C3CC3)CCNCC2)C1
InChIInChI=1S/C12H22N2/c1-2-10-14(9-1)12(11-3-4-11)5-7-13-8-6-12/h11,13H,1-10H2
InChIKeyNNRJLGIWXWBEOV-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.61
Rot. Bonds2

About 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine

4-cyclopropyl-4-pyrrolidin-1-ylpiperidine (PubChem CID 125453347) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine.

Molecular Properties

Compound Name4-cyclopropyl-4-pyrrolidin-1-ylpiperidine
PubChem CID125453347
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name4-cyclopropyl-4-pyrrolidin-1-ylpiperidine
SMILESC1CCN(C2(C3CC3)CCNCC2)C1
InChIInChI=1S/C12H22N2/c1-2-10-14(9-1)12(11-3-4-11)5-7-13-8-6-12/h11,13H,1-10H2
InChIKeyNNRJLGIWXWBEOV-UHFFFAOYSA-N
XLogP1.61
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine 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 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine?
The IUPAC name of 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine (CID 125453347) is 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine.
What is the SMILES notation for 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine?
The canonical SMILES for 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine is C1CCN(C2(C3CC3)CCNCC2)C1.
What is the InChIKey of 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine?
The InChIKey is NNRJLGIWXWBEOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2/c1-2-10-14(9-1)12(11-3-4-11)5-7-13-8-6-12/h11,13H,1-10H2.
What are the key properties of 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine?
4-cyclopropyl-4-pyrrolidin-1-ylpiperidine has a molecular weight of 194.32 g/mol, XLogP of 1.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-4-pyrrolidin-1-ylpiperidine is sourced from PubChem (CID 125453347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).