3-(2-ethoxyphenyl)-1,2,4-triazine

C11H11N3O — CID 139592958

IUPAC3-(2-ethoxyphenyl)-1,2,4-triazine
SMILESCCOc1ccccc1-c1nccnn1
InChIInChI=1S/C11H11N3O/c1-2-15-10-6-4-3-5-9(10)11-12-7-8-13-14-11/h3-8H,2H2,1H3
InChIKeyAJFRAPZJHFUYFK-UHFFFAOYSA-N
MW201.23 g/mol
LogP1.94
Rot. Bonds3

About 3-(2-ethoxyphenyl)-1,2,4-triazine

3-(2-ethoxyphenyl)-1,2,4-triazine (PubChem CID 139592958) has the molecular formula C11H11N3O and a molecular weight of 201.23 g/mol. Its IUPAC name is 3-(2-ethoxyphenyl)-1,2,4-triazine.

Molecular Properties

Compound Name3-(2-ethoxyphenyl)-1,2,4-triazine
PubChem CID139592958
Molecular FormulaC11H11N3O
Molecular Weight201.23 g/mol
Exact Mass201.09
IUPAC Name3-(2-ethoxyphenyl)-1,2,4-triazine
SMILESCCOc1ccccc1-c1nccnn1
InChIInChI=1S/C11H11N3O/c1-2-15-10-6-4-3-5-9(10)11-12-7-8-13-14-11/h3-8H,2H2,1H3
InChIKeyAJFRAPZJHFUYFK-UHFFFAOYSA-N
XLogP1.94
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.23
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[2-(1,2,4-triazin-3-yl)phenoxy]hexan-2-ol
CID 150196072
4-(2-ethoxyphenyl)pyridine
CID 23466193
1-ethoxy-2-[4-(4-phenylphenyl)phenyl]benzene
CID 151505413
N-[[2-(2-ethoxyphenyl)pyrimidin-4-yl]methyl]ethanamine
CID 115534303
1-[4-(2-ethoxyphenyl)phenyl]ethanone
CID 62801533
4-(2-ethoxyphenyl)-1,3,5-triazin-2-amine
CID 115534558
3-(2-ethoxyphenyl)-5-ethyl-1H-1,2,4-triazole
CID 61277730
3-ethoxy-2-fluoropyridine
CID 11355527
N-[1-[3-(2-ethoxyphenyl)-1,2,4-triazin-5-yl]butylidene]hydroxylamine
CID 139593000
4-(2-ethoxyphenyl)phenol
CID 83129672
ethane;3-ethoxy-2-fluoropyridine
CID 144753234
4-chloro-2-(2-ethoxyphenyl)pyridine
CID 102825098

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethoxyphenyl)-1,2,4-triazine?
The IUPAC name of 3-(2-ethoxyphenyl)-1,2,4-triazine (CID 139592958) is 3-(2-ethoxyphenyl)-1,2,4-triazine.
What is the SMILES notation for 3-(2-ethoxyphenyl)-1,2,4-triazine?
The canonical SMILES for 3-(2-ethoxyphenyl)-1,2,4-triazine is CCOc1ccccc1-c1nccnn1.
What is the InChIKey of 3-(2-ethoxyphenyl)-1,2,4-triazine?
The InChIKey is AJFRAPZJHFUYFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-2-15-10-6-4-3-5-9(10)11-12-7-8-13-14-11/h3-8H,2H2,1H3.
What are the key properties of 3-(2-ethoxyphenyl)-1,2,4-triazine?
3-(2-ethoxyphenyl)-1,2,4-triazine has a molecular weight of 201.23 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethoxyphenyl)-1,2,4-triazine is sourced from PubChem (CID 139592958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).