3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one

C10H15N5O3 — CID 62859813

IUPAC3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one
SMILESCOc1nc(NC2CCCNC2=O)nc(OC)n1
InChIInChI=1S/C10H15N5O3/c1-17-9-13-8(14-10(15-9)18-2)12-6-4-3-5-11-7(6)16/h6H,3-5H2,1-2H3,(H,11,16)(H,12,13,14,15)
InChIKeyWDOHWXXFOVTLHO-UHFFFAOYSA-N
MW253.26 g/mol
LogP-0.42
Rot. Bonds4

About 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one

3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one (PubChem CID 62859813) has the molecular formula C10H15N5O3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one.

Molecular Properties

Compound Name3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one
PubChem CID62859813
Molecular FormulaC10H15N5O3
Molecular Weight253.26 g/mol
Exact Mass253.12
IUPAC Name3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one
SMILESCOc1nc(NC2CCCNC2=O)nc(OC)n1
InChIInChI=1S/C10H15N5O3/c1-17-9-13-8(14-10(15-9)18-2)12-6-4-3-5-11-7(6)16/h6H,3-5H2,1-2H3,(H,11,16)(H,12,13,14,15)
InChIKeyWDOHWXXFOVTLHO-UHFFFAOYSA-N
XLogP-0.42
TPSA98.26 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-0.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 3-[(4,6-dimethoxy-1,3,5-triazin-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 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one?
The IUPAC name of 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one (CID 62859813) is 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one.
What is the SMILES notation for 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one?
The canonical SMILES for 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one is COc1nc(NC2CCCNC2=O)nc(OC)n1.
What is the InChIKey of 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one?
The InChIKey is WDOHWXXFOVTLHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O3/c1-17-9-13-8(14-10(15-9)18-2)12-6-4-3-5-11-7(6)16/h6H,3-5H2,1-2H3,(H,11,16)(H,12,13,14,15).
What are the key properties of 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one?
3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one has a molecular weight of 253.26 g/mol, XLogP of -0.42, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]piperidin-2-one is sourced from PubChem (CID 62859813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).