N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide

C6H10N4O2 — CID 13361919

IUPACN-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide
SMILESCC(=O)NC1=NC(=O)NCN1C
InChIInChI=1S/C6H10N4O2/c1-4(11)8-5-9-6(12)7-3-10(5)2/h3H2,1-2H3,(H2,7,8,9,11,12)
InChIKeyOMIATGWQABLVAB-UHFFFAOYSA-N
MW170.17 g/mol
LogP-0.91
Rot. Bonds

About N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide

N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide (PubChem CID 13361919) has the molecular formula C6H10N4O2 and a molecular weight of 170.17 g/mol. Its IUPAC name is N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide.

Molecular Properties

Compound NameN-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide
PubChem CID13361919
Molecular FormulaC6H10N4O2
Molecular Weight170.17 g/mol
Exact Mass170.08
IUPAC NameN-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide
SMILESCC(=O)NC1=NC(=O)NCN1C
InChIInChI=1S/C6H10N4O2/c1-4(11)8-5-9-6(12)7-3-10(5)2/h3H2,1-2H3,(H2,7,8,9,11,12)
InChIKeyOMIATGWQABLVAB-UHFFFAOYSA-N
XLogP-0.91
TPSA73.80 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.17
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide?
The IUPAC name of N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide (CID 13361919) is N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide.
What is the SMILES notation for N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide?
The canonical SMILES for N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide is CC(=O)NC1=NC(=O)NCN1C.
What is the InChIKey of N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide?
The InChIKey is OMIATGWQABLVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O2/c1-4(11)8-5-9-6(12)7-3-10(5)2/h3H2,1-2H3,(H2,7,8,9,11,12).
What are the key properties of N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide?
N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide has a molecular weight of 170.17 g/mol, XLogP of -0.91, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-6-oxo-1,2-dihydro-1,3,5-triazin-4-yl)acetamide is sourced from PubChem (CID 13361919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).