6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione

C8H14N4O3 — CID 60658652

IUPAC6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCN(CCO)c1nn(C)c(=O)n(C)c1=O
InChIInChI=1S/C8H14N4O3/c1-10(4-5-13)6-7(14)11(2)8(15)12(3)9-6/h13H,4-5H2,1-3H3
InChIKeyJDJQYKZMZTVOSP-UHFFFAOYSA-N
MW214.22 g/mol
LogP-2.09
Rot. Bonds3

About 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione

6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione (PubChem CID 60658652) has the molecular formula C8H14N4O3 and a molecular weight of 214.22 g/mol. Its IUPAC name is 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione.

Molecular Properties

Compound Name6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
PubChem CID60658652
Molecular FormulaC8H14N4O3
Molecular Weight214.22 g/mol
Exact Mass214.11
IUPAC Name6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCN(CCO)c1nn(C)c(=O)n(C)c1=O
InChIInChI=1S/C8H14N4O3/c1-10(4-5-13)6-7(14)11(2)8(15)12(3)9-6/h13H,4-5H2,1-3H3
InChIKeyJDJQYKZMZTVOSP-UHFFFAOYSA-N
XLogP-2.09
TPSA80.36 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.22
LogP ≤ 5-2.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The IUPAC name of 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione (CID 60658652) is 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione.
What is the SMILES notation for 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The canonical SMILES for 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione is CN(CCO)c1nn(C)c(=O)n(C)c1=O.
What is the InChIKey of 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The InChIKey is JDJQYKZMZTVOSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O3/c1-10(4-5-13)6-7(14)11(2)8(15)12(3)9-6/h13H,4-5H2,1-3H3.
What are the key properties of 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione?
6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione has a molecular weight of 214.22 g/mol, XLogP of -2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-hydroxyethyl(methyl)amino]-2,4-dimethyl-1,2,4-triazine-3,5-dione is sourced from PubChem (CID 60658652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).