N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide

C9H13N5O2 — CID 71335755

IUPACN-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide
SMILESCC(=O)N(C)c1ncnc(N(C)C(C)=O)n1
InChIInChI=1S/C9H13N5O2/c1-6(15)13(3)8-10-5-11-9(12-8)14(4)7(2)16/h5H,1-4H3
InChIKeyFQEFYSJQAOOYSS-UHFFFAOYSA-N
MW223.24 g/mol
LogP-0.16
Rot. Bonds2

About N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide

N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide (PubChem CID 71335755) has the molecular formula C9H13N5O2 and a molecular weight of 223.24 g/mol. Its IUPAC name is N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide.

Molecular Properties

Compound NameN-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide
PubChem CID71335755
Molecular FormulaC9H13N5O2
Molecular Weight223.24 g/mol
Exact Mass223.11
IUPAC NameN-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide
SMILESCC(=O)N(C)c1ncnc(N(C)C(C)=O)n1
InChIInChI=1S/C9H13N5O2/c1-6(15)13(3)8-10-5-11-9(12-8)14(4)7(2)16/h5H,1-4H3
InChIKeyFQEFYSJQAOOYSS-UHFFFAOYSA-N
XLogP-0.16
TPSA79.29 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 5-0.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide 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 N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide?
The IUPAC name of N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide (CID 71335755) is N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide.
What is the SMILES notation for N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide?
The canonical SMILES for N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide is CC(=O)N(C)c1ncnc(N(C)C(C)=O)n1.
What is the InChIKey of N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide?
The InChIKey is FQEFYSJQAOOYSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N5O2/c1-6(15)13(3)8-10-5-11-9(12-8)14(4)7(2)16/h5H,1-4H3.
What are the key properties of N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide?
N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide has a molecular weight of 223.24 g/mol, XLogP of -0.16, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[acetyl(methyl)amino]-1,3,5-triazin-2-yl]-N-methylacetamide is sourced from PubChem (CID 71335755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).