(3-aminopiperidin-1-yl)-cyclopropylmethanone

C9H16N2O — CID 25219399

IUPAC(3-aminopiperidin-1-yl)-cyclopropylmethanone
SMILESNC1CCCN(C(=O)C2CC2)C1
InChIInChI=1S/C9H16N2O/c10-8-2-1-5-11(6-8)9(12)7-3-4-7/h7-8H,1-6,10H2
InChIKeyWLLZJPLISPRNPJ-UHFFFAOYSA-N
MW168.24 g/mol
LogP0.35
Rot. Bonds1

About (3-aminopiperidin-1-yl)-cyclopropylmethanone

(3-aminopiperidin-1-yl)-cyclopropylmethanone (PubChem CID 25219399) has the molecular formula C9H16N2O and a molecular weight of 168.24 g/mol. Its IUPAC name is (3-aminopiperidin-1-yl)-cyclopropylmethanone.

Molecular Properties

Compound Name(3-aminopiperidin-1-yl)-cyclopropylmethanone
PubChem CID25219399
Molecular FormulaC9H16N2O
Molecular Weight168.24 g/mol
Exact Mass168.13
IUPAC Name(3-aminopiperidin-1-yl)-cyclopropylmethanone
SMILESNC1CCCN(C(=O)C2CC2)C1
InChIInChI=1S/C9H16N2O/c10-8-2-1-5-11(6-8)9(12)7-3-4-7/h7-8H,1-6,10H2
InChIKeyWLLZJPLISPRNPJ-UHFFFAOYSA-N
XLogP0.35
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 50.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-aminopiperidin-1-yl)-cyclopropylmethanone 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 (3-aminopiperidin-1-yl)-cyclopropylmethanone?
The IUPAC name of (3-aminopiperidin-1-yl)-cyclopropylmethanone (CID 25219399) is (3-aminopiperidin-1-yl)-cyclopropylmethanone.
What is the SMILES notation for (3-aminopiperidin-1-yl)-cyclopropylmethanone?
The canonical SMILES for (3-aminopiperidin-1-yl)-cyclopropylmethanone is NC1CCCN(C(=O)C2CC2)C1.
What is the InChIKey of (3-aminopiperidin-1-yl)-cyclopropylmethanone?
The InChIKey is WLLZJPLISPRNPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O/c10-8-2-1-5-11(6-8)9(12)7-3-4-7/h7-8H,1-6,10H2.
What are the key properties of (3-aminopiperidin-1-yl)-cyclopropylmethanone?
(3-aminopiperidin-1-yl)-cyclopropylmethanone has a molecular weight of 168.24 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 (3-aminopiperidin-1-yl)-cyclopropylmethanone is sourced from PubChem (CID 25219399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).