1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one

C11H17N5O — CID 80843926

IUPAC1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one
SMILESCNc1cncc(NC2CCC(=O)N(C)C2)n1
InChIInChI=1S/C11H17N5O/c1-12-9-5-13-6-10(15-9)14-8-3-4-11(17)16(2)7-8/h5-6,8H,3-4,7H2,1-2H3,(H2,12,14,15)
InChIKeyFJEGSJCZCHCVCC-UHFFFAOYSA-N
MW235.29 g/mol
LogP0.55
Rot. Bonds3

About 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one

1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one (PubChem CID 80843926) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one.

Molecular Properties

Compound Name1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one
PubChem CID80843926
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one
SMILESCNc1cncc(NC2CCC(=O)N(C)C2)n1
InChIInChI=1S/C11H17N5O/c1-12-9-5-13-6-10(15-9)14-8-3-4-11(17)16(2)7-8/h5-6,8H,3-4,7H2,1-2H3,(H2,12,14,15)
InChIKeyFJEGSJCZCHCVCC-UHFFFAOYSA-N
XLogP0.55
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 50.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]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 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one?
The IUPAC name of 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one (CID 80843926) is 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one.
What is the SMILES notation for 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one?
The canonical SMILES for 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one is CNc1cncc(NC2CCC(=O)N(C)C2)n1.
What is the InChIKey of 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one?
The InChIKey is FJEGSJCZCHCVCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-12-9-5-13-6-10(15-9)14-8-3-4-11(17)16(2)7-8/h5-6,8H,3-4,7H2,1-2H3,(H2,12,14,15).
What are the key properties of 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one?
1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one has a molecular weight of 235.29 g/mol, XLogP of 0.55, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-5-[[6-(methylamino)pyrazin-2-yl]amino]piperidin-2-one is sourced from PubChem (CID 80843926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).