5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one

C13H17N5O — CID 55226100

IUPAC5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one
SMILESCc1cc2ncc(CNC3CCC(=O)NC3)cn2n1
InChIInChI=1S/C13H17N5O/c1-9-4-12-15-6-10(8-18(12)17-9)5-14-11-2-3-13(19)16-7-11/h4,6,8,11,14H,2-3,5,7H2,1H3,(H,16,19)
InChIKeyZHVHMYZOSHBOGY-UHFFFAOYSA-N
MW259.31 g/mol
LogP0.41
Rot. Bonds3

About 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one

5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one (PubChem CID 55226100) has the molecular formula C13H17N5O and a molecular weight of 259.31 g/mol. Its IUPAC name is 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one.

Molecular Properties

Compound Name5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one
PubChem CID55226100
Molecular FormulaC13H17N5O
Molecular Weight259.31 g/mol
Exact Mass259.14
IUPAC Name5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one
SMILESCc1cc2ncc(CNC3CCC(=O)NC3)cn2n1
InChIInChI=1S/C13H17N5O/c1-9-4-12-15-6-10(8-18(12)17-9)5-14-11-2-3-13(19)16-7-11/h4,6,8,11,14H,2-3,5,7H2,1H3,(H,16,19)
InChIKeyZHVHMYZOSHBOGY-UHFFFAOYSA-N
XLogP0.41
TPSA71.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 50.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-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-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one?
The IUPAC name of 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one (CID 55226100) is 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one.
What is the SMILES notation for 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one?
The canonical SMILES for 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one is Cc1cc2ncc(CNC3CCC(=O)NC3)cn2n1.
What is the InChIKey of 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one?
The InChIKey is ZHVHMYZOSHBOGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5O/c1-9-4-12-15-6-10(8-18(12)17-9)5-14-11-2-3-13(19)16-7-11/h4,6,8,11,14H,2-3,5,7H2,1H3,(H,16,19).
What are the key properties of 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one?
5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one has a molecular weight of 259.31 g/mol, XLogP of 0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-methylpyrazolo[1,5-a]pyrimidin-6-yl)methylamino]piperidin-2-one is sourced from PubChem (CID 55226100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).