4-ethoxytriazine

C5H7N3O — CID 23323025

IUPAC4-ethoxytriazine
SMILESCCOc1ccnnn1
InChIInChI=1S/C5H7N3O/c1-2-9-5-3-4-6-8-7-5/h3-4H,2H2,1H3
InChIKeyZPECLGVYJKUVTC-UHFFFAOYSA-N
MW125.13 g/mol
LogP0.27
Rot. Bonds2

About 4-ethoxytriazine

4-ethoxytriazine (PubChem CID 23323025) has the molecular formula C5H7N3O and a molecular weight of 125.13 g/mol. Its IUPAC name is 4-ethoxytriazine.

Molecular Properties

Compound Name4-ethoxytriazine
PubChem CID23323025
Molecular FormulaC5H7N3O
Molecular Weight125.13 g/mol
Exact Mass125.06
IUPAC Name4-ethoxytriazine
SMILESCCOc1ccnnn1
InChIInChI=1S/C5H7N3O/c1-2-9-5-3-4-6-8-7-5/h3-4H,2H2,1H3
InChIKeyZPECLGVYJKUVTC-UHFFFAOYSA-N
XLogP0.27
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.13
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Methoxytriazine
CID 22168417
Triazinyl acetate
CID 129812309
1-Fluoro-3-(2-methylpropoxy)pyrazole
CID 121273344
4-(2,2,2-Trifluoroethoxy)triazine
CID 153681004
Thiomethoxytriazine
CID 129662295
Tricyanomethoxytriazine
CID 129778828
Cyanomethoxytriazine
CID 129798959
4-(Chloromethoxy)triazine
CID 18934300
4-(Trichloromethoxy)triazine
CID 19104358
4-Butoxytriazine
CID 19742567
4-(Dichloromethoxy)triazine
CID 19963552
4-Propoxytriazine
CID 20034771

Frequently Asked Questions

What is the IUPAC name of 4-ethoxytriazine?
The IUPAC name of 4-ethoxytriazine (CID 23323025) is 4-ethoxytriazine.
What is the SMILES notation for 4-ethoxytriazine?
The canonical SMILES for 4-ethoxytriazine is CCOc1ccnnn1.
What is the InChIKey of 4-ethoxytriazine?
The InChIKey is ZPECLGVYJKUVTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7N3O/c1-2-9-5-3-4-6-8-7-5/h3-4H,2H2,1H3.
What are the key properties of 4-ethoxytriazine?
4-ethoxytriazine has a molecular weight of 125.13 g/mol, XLogP of 0.27, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxytriazine is sourced from PubChem (CID 23323025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).