3-(4-aminopiperidin-1-yl)oxolan-2-one

C9H16N2O2 — CID 43556645

IUPAC3-(4-aminopiperidin-1-yl)oxolan-2-one
SMILESNC1CCN(C2CCOC2=O)CC1
InChIInChI=1S/C9H16N2O2/c10-7-1-4-11(5-2-7)8-3-6-13-9(8)12/h7-8H,1-6,10H2
InChIKeyTZAWQAWBBYBXOO-UHFFFAOYSA-N
MW184.24 g/mol
LogP-0.28
Rot. Bonds1

About 3-(4-aminopiperidin-1-yl)oxolan-2-one

3-(4-aminopiperidin-1-yl)oxolan-2-one (PubChem CID 43556645) has the molecular formula C9H16N2O2 and a molecular weight of 184.24 g/mol. Its IUPAC name is 3-(4-aminopiperidin-1-yl)oxolan-2-one.

Molecular Properties

Compound Name3-(4-aminopiperidin-1-yl)oxolan-2-one
PubChem CID43556645
Molecular FormulaC9H16N2O2
Molecular Weight184.24 g/mol
Exact Mass184.12
IUPAC Name3-(4-aminopiperidin-1-yl)oxolan-2-one
SMILESNC1CCN(C2CCOC2=O)CC1
InChIInChI=1S/C9H16N2O2/c10-7-1-4-11(5-2-7)8-3-6-13-9(8)12/h7-8H,1-6,10H2
InChIKeyTZAWQAWBBYBXOO-UHFFFAOYSA-N
XLogP-0.28
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.24
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(4-aminopiperidin-1-yl)oxolan-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(Cyclohexylamino)oxolan-2-one;hydrochloride
CID 71455995
3-(4-Aminopiperidin-1-yl)oxolan-2-one dihydrochloride
CID 71756967
Butyl 2-(4-aminopiperidin-1-yl)acetate
CID 10608685
3-(Piperazin-1-yl)oxolan-2-one dihydrochloride
CID 43176436
3-[4-[5-(2,2,2-Trifluoroethylamino)pentyl]piperazin-1-yl]oxolan-2-one
CID 173504417
3-(Cyclohexylamino)oxolan-2-one
CID 43824131
Ethyl 2-(4-aminopiperidin-1-yl)acetate
CID 16775205
3-Piperidin-1-yloxolan-2-one
CID 22893188
(3S)-3-(pentylamino)oxolan-2-one
CID 28563677
Ethyl 2-[(1-methylpiperidin-4-yl)amino]acetate
CID 43216275
Ethyl 2-[methyl(4-piperidyl)amino]acetate
CID 43607703
3-(Pentylamino)oxolan-2-one
CID 43825738

Frequently Asked Questions

What is the IUPAC name of 3-(4-aminopiperidin-1-yl)oxolan-2-one?
The IUPAC name of 3-(4-aminopiperidin-1-yl)oxolan-2-one (CID 43556645) is 3-(4-aminopiperidin-1-yl)oxolan-2-one.
What is the SMILES notation for 3-(4-aminopiperidin-1-yl)oxolan-2-one?
The canonical SMILES for 3-(4-aminopiperidin-1-yl)oxolan-2-one is NC1CCN(C2CCOC2=O)CC1.
What is the InChIKey of 3-(4-aminopiperidin-1-yl)oxolan-2-one?
The InChIKey is TZAWQAWBBYBXOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O2/c10-7-1-4-11(5-2-7)8-3-6-13-9(8)12/h7-8H,1-6,10H2.
What are the key properties of 3-(4-aminopiperidin-1-yl)oxolan-2-one?
3-(4-aminopiperidin-1-yl)oxolan-2-one has a molecular weight of 184.24 g/mol, XLogP of -0.28, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-aminopiperidin-1-yl)oxolan-2-one is sourced from PubChem (CID 43556645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).