1-(4-aminopiperidin-1-yl)ethanone

C7H14N2O — CID 4962477

IUPAC1-(4-aminopiperidin-1-yl)ethanone
SMILESCC(=O)N1CCC(N)CC1
InChIInChI=1S/C7H14N2O/c1-6(10)9-4-2-7(8)3-5-9/h7H,2-5,8H2,1H3
InChIKeyNLHBHVGPMMXWIM-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.04
Rot. Bonds

About 1-(4-aminopiperidin-1-yl)ethanone

1-(4-aminopiperidin-1-yl)ethanone (PubChem CID 4962477) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-(4-aminopiperidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(4-aminopiperidin-1-yl)ethanone
PubChem CID4962477
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name1-(4-aminopiperidin-1-yl)ethanone
SMILESCC(=O)N1CCC(N)CC1
InChIInChI=1S/C7H14N2O/c1-6(10)9-4-2-7(8)3-5-9/h7H,2-5,8H2,1H3
InChIKeyNLHBHVGPMMXWIM-UHFFFAOYSA-N
XLogP-0.04
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-aminopiperidin-1-yl)ethanone 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 1-(4-aminopiperidin-1-yl)ethanone?
The IUPAC name of 1-(4-aminopiperidin-1-yl)ethanone (CID 4962477) is 1-(4-aminopiperidin-1-yl)ethanone.
What is the SMILES notation for 1-(4-aminopiperidin-1-yl)ethanone?
The canonical SMILES for 1-(4-aminopiperidin-1-yl)ethanone is CC(=O)N1CCC(N)CC1.
What is the InChIKey of 1-(4-aminopiperidin-1-yl)ethanone?
The InChIKey is NLHBHVGPMMXWIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-6(10)9-4-2-7(8)3-5-9/h7H,2-5,8H2,1H3.
What are the key properties of 1-(4-aminopiperidin-1-yl)ethanone?
1-(4-aminopiperidin-1-yl)ethanone has a molecular weight of 142.20 g/mol, XLogP of -0.04, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminopiperidin-1-yl)ethanone is sourced from PubChem (CID 4962477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).