2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one

C11H21N3O — CID 43089571

IUPAC2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one
SMILESCC(C(=O)N1CCCC1)N1CCNCC1
InChIInChI=1S/C11H21N3O/c1-10(13-8-4-12-5-9-13)11(15)14-6-2-3-7-14/h10,12H,2-9H2,1H3
InChIKeyHAOIQARFNNZHFD-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.10
Rot. Bonds2

About 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one

2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one (PubChem CID 43089571) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one.

Molecular Properties

Compound Name2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one
PubChem CID43089571
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one
SMILESCC(C(=O)N1CCCC1)N1CCNCC1
InChIInChI=1S/C11H21N3O/c1-10(13-8-4-12-5-9-13)11(15)14-6-2-3-7-14/h10,12H,2-9H2,1H3
InChIKeyHAOIQARFNNZHFD-UHFFFAOYSA-N
XLogP-0.10
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-0.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one 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-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one?
The IUPAC name of 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one (CID 43089571) is 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one.
What is the SMILES notation for 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one?
The canonical SMILES for 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one is CC(C(=O)N1CCCC1)N1CCNCC1.
What is the InChIKey of 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one?
The InChIKey is HAOIQARFNNZHFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-10(13-8-4-12-5-9-13)11(15)14-6-2-3-7-14/h10,12H,2-9H2,1H3.
What are the key properties of 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one?
2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one has a molecular weight of 211.31 g/mol, XLogP of -0.10, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-piperazin-1-yl-1-pyrrolidin-1-ylpropan-1-one is sourced from PubChem (CID 43089571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).