5,6-diethyl-3-methyl-1,2,4-triazine

C8H13N3 — CID 15906352

IUPAC5,6-diethyl-3-methyl-1,2,4-triazine
SMILESCCc1nnc(C)nc1CC
InChIInChI=1S/C8H13N3/c1-4-7-8(5-2)11-10-6(3)9-7/h4-5H2,1-3H3
InChIKeyHQIHUGQUNOCQME-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.30
Rot. Bonds2

About 5,6-diethyl-3-methyl-1,2,4-triazine

5,6-diethyl-3-methyl-1,2,4-triazine (PubChem CID 15906352) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 5,6-diethyl-3-methyl-1,2,4-triazine.

Molecular Properties

Compound Name5,6-diethyl-3-methyl-1,2,4-triazine
PubChem CID15906352
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name5,6-diethyl-3-methyl-1,2,4-triazine
SMILESCCc1nnc(C)nc1CC
InChIInChI=1S/C8H13N3/c1-4-7-8(5-2)11-10-6(3)9-7/h4-5H2,1-3H3
InChIKeyHQIHUGQUNOCQME-UHFFFAOYSA-N
XLogP1.30
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,6-diethyl-3-methyl-1,2,4-triazine?
The IUPAC name of 5,6-diethyl-3-methyl-1,2,4-triazine (CID 15906352) is 5,6-diethyl-3-methyl-1,2,4-triazine.
What is the SMILES notation for 5,6-diethyl-3-methyl-1,2,4-triazine?
The canonical SMILES for 5,6-diethyl-3-methyl-1,2,4-triazine is CCc1nnc(C)nc1CC.
What is the InChIKey of 5,6-diethyl-3-methyl-1,2,4-triazine?
The InChIKey is HQIHUGQUNOCQME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-4-7-8(5-2)11-10-6(3)9-7/h4-5H2,1-3H3.
What are the key properties of 5,6-diethyl-3-methyl-1,2,4-triazine?
5,6-diethyl-3-methyl-1,2,4-triazine has a molecular weight of 151.21 g/mol, XLogP of 1.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-diethyl-3-methyl-1,2,4-triazine is sourced from PubChem (CID 15906352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).