2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone

C11H20N2O — CID 29083930

IUPAC2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
SMILESO=C(C[C@@H]1CCCCN1)N1CCCC1
InChIInChI=1S/C11H20N2O/c14-11(13-7-3-4-8-13)9-10-5-1-2-6-12-10/h10,12H,1-9H2/t10-/m0/s1
InChIKeyGOGYNZMOTKUCDG-JTQLQIEISA-N
MW196.29 g/mol
LogP1.14
Rot. Bonds2

About 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone

2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone (PubChem CID 29083930) has the molecular formula C11H20N2O and a molecular weight of 196.29 g/mol. Its IUPAC name is 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone.

Molecular Properties

Compound Name2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
PubChem CID29083930
Molecular FormulaC11H20N2O
Molecular Weight196.29 g/mol
Exact Mass196.16
IUPAC Name2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone
SMILESO=C(C[C@@H]1CCCCN1)N1CCCC1
InChIInChI=1S/C11H20N2O/c14-11(13-7-3-4-8-13)9-10-5-1-2-6-12-10/h10,12H,1-9H2/t10-/m0/s1
InChIKeyGOGYNZMOTKUCDG-JTQLQIEISA-N
XLogP1.14
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.29
LogP ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone?
The IUPAC name of 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone (CID 29083930) is 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone.
What is the SMILES notation for 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone?
The canonical SMILES for 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone is O=C(C[C@@H]1CCCCN1)N1CCCC1.
What is the InChIKey of 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone?
The InChIKey is GOGYNZMOTKUCDG-JTQLQIEISA-N. The full InChI is InChI=1S/C11H20N2O/c14-11(13-7-3-4-8-13)9-10-5-1-2-6-12-10/h10,12H,1-9H2/t10-/m0/s1.
What are the key properties of 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone?
2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone has a molecular weight of 196.29 g/mol, XLogP of 1.14, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2S)-piperidin-2-yl]-1-pyrrolidin-1-ylethanone is sourced from PubChem (CID 29083930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).