2-amino-1-piperidin-1-ylpropan-1-one

C8H16N2O — CID 3152952

IUPAC2-amino-1-piperidin-1-ylpropan-1-one
SMILESCC(N)C(=O)N1CCCCC1
InChIInChI=1S/C8H16N2O/c1-7(9)8(11)10-5-3-2-4-6-10/h7H,2-6,9H2,1H3
InChIKeyWHBVSWNJAJECCU-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.35
Rot. Bonds1

About 2-amino-1-piperidin-1-ylpropan-1-one

2-amino-1-piperidin-1-ylpropan-1-one (PubChem CID 3152952) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-amino-1-piperidin-1-ylpropan-1-one.

Molecular Properties

Compound Name2-amino-1-piperidin-1-ylpropan-1-one
PubChem CID3152952
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-amino-1-piperidin-1-ylpropan-1-one
SMILESCC(N)C(=O)N1CCCCC1
InChIInChI=1S/C8H16N2O/c1-7(9)8(11)10-5-3-2-4-6-10/h7H,2-6,9H2,1H3
InChIKeyWHBVSWNJAJECCU-UHFFFAOYSA-N
XLogP0.35
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-amino-1-piperidin-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-amino-1-piperidin-1-ylpropan-1-one?
The IUPAC name of 2-amino-1-piperidin-1-ylpropan-1-one (CID 3152952) is 2-amino-1-piperidin-1-ylpropan-1-one.
What is the SMILES notation for 2-amino-1-piperidin-1-ylpropan-1-one?
The canonical SMILES for 2-amino-1-piperidin-1-ylpropan-1-one is CC(N)C(=O)N1CCCCC1.
What is the InChIKey of 2-amino-1-piperidin-1-ylpropan-1-one?
The InChIKey is WHBVSWNJAJECCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-7(9)8(11)10-5-3-2-4-6-10/h7H,2-6,9H2,1H3.
What are the key properties of 2-amino-1-piperidin-1-ylpropan-1-one?
2-amino-1-piperidin-1-ylpropan-1-one has a molecular weight of 156.23 g/mol, XLogP of 0.35, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-piperidin-1-ylpropan-1-one is sourced from PubChem (CID 3152952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).