2-amino-1-piperidin-4-ylethanone

C7H14N2O — CID 24820212

IUPAC2-amino-1-piperidin-4-ylethanone
SMILESNCC(=O)C1CCNCC1
InChIInChI=1S/C7H14N2O/c8-5-7(10)6-1-3-9-4-2-6/h6,9H,1-5,8H2
InChIKeyGPGILGOETHWXGH-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.49
Rot. Bonds2

About 2-amino-1-piperidin-4-ylethanone

2-amino-1-piperidin-4-ylethanone (PubChem CID 24820212) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-amino-1-piperidin-4-ylethanone.

Molecular Properties

Compound Name2-amino-1-piperidin-4-ylethanone
PubChem CID24820212
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name2-amino-1-piperidin-4-ylethanone
SMILESNCC(=O)C1CCNCC1
InChIInChI=1S/C7H14N2O/c8-5-7(10)6-1-3-9-4-2-6/h6,9H,1-5,8H2
InChIKeyGPGILGOETHWXGH-UHFFFAOYSA-N
XLogP-0.49
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-1-piperidin-4-ylethanone 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-4-ylethanone?
The IUPAC name of 2-amino-1-piperidin-4-ylethanone (CID 24820212) is 2-amino-1-piperidin-4-ylethanone.
What is the SMILES notation for 2-amino-1-piperidin-4-ylethanone?
The canonical SMILES for 2-amino-1-piperidin-4-ylethanone is NCC(=O)C1CCNCC1.
What is the InChIKey of 2-amino-1-piperidin-4-ylethanone?
The InChIKey is GPGILGOETHWXGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c8-5-7(10)6-1-3-9-4-2-6/h6,9H,1-5,8H2.
What are the key properties of 2-amino-1-piperidin-4-ylethanone?
2-amino-1-piperidin-4-ylethanone has a molecular weight of 142.20 g/mol, XLogP of -0.49, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-piperidin-4-ylethanone is sourced from PubChem (CID 24820212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).