5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one

C11H17N3O — CID 144642068

IUPAC5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one
SMILESCn1cc(C2CCNCC2N)ccc1=O
InChIInChI=1S/C11H17N3O/c1-14-7-8(2-3-11(14)15)9-4-5-13-6-10(9)12/h2-3,7,9-10,13H,4-6,12H2,1H3
InChIKeyNXQSNWFSASDYNZ-UHFFFAOYSA-N
MW207.28 g/mol
LogP-0.21
Rot. Bonds1

About 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one

5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one (PubChem CID 144642068) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one.

Molecular Properties

Compound Name5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one
PubChem CID144642068
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one
SMILESCn1cc(C2CCNCC2N)ccc1=O
InChIInChI=1S/C11H17N3O/c1-14-7-8(2-3-11(14)15)9-4-5-13-6-10(9)12/h2-3,7,9-10,13H,4-6,12H2,1H3
InChIKeyNXQSNWFSASDYNZ-UHFFFAOYSA-N
XLogP-0.21
TPSA60.05 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 5-0.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(3-aminopiperidin-4-yl)-1-methylpyridin-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

Frequently Asked Questions

What is the IUPAC name of 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one?
The IUPAC name of 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one (CID 144642068) is 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one.
What is the SMILES notation for 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one?
The canonical SMILES for 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one is Cn1cc(C2CCNCC2N)ccc1=O.
What is the InChIKey of 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one?
The InChIKey is NXQSNWFSASDYNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-14-7-8(2-3-11(14)15)9-4-5-13-6-10(9)12/h2-3,7,9-10,13H,4-6,12H2,1H3.
What are the key properties of 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one?
5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one has a molecular weight of 207.28 g/mol, XLogP of -0.21, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-aminopiperidin-4-yl)-1-methylpyridin-2-one is sourced from PubChem (CID 144642068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).