6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione

C7H12N4O2 — CID 43410435

IUPAC6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCCNc1nn(C)c(=O)n(C)c1=O
InChIInChI=1S/C7H12N4O2/c1-4-8-5-6(12)10(2)7(13)11(3)9-5/h4H2,1-3H3,(H,8,9)
InChIKeyAKSOTPMMOLHDTI-UHFFFAOYSA-N
MW184.20 g/mol
LogP-1.09
Rot. Bonds2

About 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione

6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione (PubChem CID 43410435) has the molecular formula C7H12N4O2 and a molecular weight of 184.20 g/mol. Its IUPAC name is 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione.

Molecular Properties

Compound Name6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione
PubChem CID43410435
Molecular FormulaC7H12N4O2
Molecular Weight184.20 g/mol
Exact Mass184.10
IUPAC Name6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione
SMILESCCNc1nn(C)c(=O)n(C)c1=O
InChIInChI=1S/C7H12N4O2/c1-4-8-5-6(12)10(2)7(13)11(3)9-5/h4H2,1-3H3,(H,8,9)
InChIKeyAKSOTPMMOLHDTI-UHFFFAOYSA-N
XLogP-1.09
TPSA68.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.20
LogP ≤ 5-1.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The IUPAC name of 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione (CID 43410435) is 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione.
What is the SMILES notation for 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The canonical SMILES for 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione is CCNc1nn(C)c(=O)n(C)c1=O.
What is the InChIKey of 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione?
The InChIKey is AKSOTPMMOLHDTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O2/c1-4-8-5-6(12)10(2)7(13)11(3)9-5/h4H2,1-3H3,(H,8,9).
What are the key properties of 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione?
6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione has a molecular weight of 184.20 g/mol, XLogP of -1.09, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(ethylamino)-2,4-dimethyl-1,2,4-triazine-3,5-dione is sourced from PubChem (CID 43410435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).