2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine

C17H34N2 — CID 24748229

IUPAC2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine
SMILESCCCCC1(CC)C(N2CCCC2)CCCN1CC
InChIInChI=1S/C17H34N2/c1-4-7-12-17(5-2)16(18-13-8-9-14-18)11-10-15-19(17)6-3/h16H,4-15H2,1-3H3
InChIKeyIWZXMDHPJSRNBP-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.91
Rot. Bonds6

About 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine

2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine (PubChem CID 24748229) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine.

Molecular Properties

Compound Name2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine
PubChem CID24748229
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine
SMILESCCCCC1(CC)C(N2CCCC2)CCCN1CC
InChIInChI=1S/C17H34N2/c1-4-7-12-17(5-2)16(18-13-8-9-14-18)11-10-15-19(17)6-3/h16H,4-15H2,1-3H3
InChIKeyIWZXMDHPJSRNBP-UHFFFAOYSA-N
XLogP3.91
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-butyl-1,2-diethyl-3-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 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine?
The IUPAC name of 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine (CID 24748229) is 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine.
What is the SMILES notation for 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine?
The canonical SMILES for 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine is CCCCC1(CC)C(N2CCCC2)CCCN1CC.
What is the InChIKey of 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine?
The InChIKey is IWZXMDHPJSRNBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-4-7-12-17(5-2)16(18-13-8-9-14-18)11-10-15-19(17)6-3/h16H,4-15H2,1-3H3.
What are the key properties of 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine?
2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine has a molecular weight of 266.47 g/mol, XLogP of 3.91, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-1,2-diethyl-3-pyrrolidin-1-ylpiperidine is sourced from PubChem (CID 24748229), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).