ethoxyethane;1,3,5-triazine

C7H13N3O — CID 69406478

IUPACethoxyethane;1,3,5-triazine
SMILESCCOCC.c1ncncn1
InChIInChI=1S/C4H10O.C3H3N3/c1-3-5-4-2;1-4-2-6-3-5-1/h3-4H2,1-2H3;1-3H
InChIKeyHSXDFSBJNZSIDJ-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.91
Rot. Bonds2

About ethoxyethane;1,3,5-triazine

ethoxyethane;1,3,5-triazine (PubChem CID 69406478) has the molecular formula C7H13N3O and a molecular weight of 155.20 g/mol. Its IUPAC name is ethoxyethane;1,3,5-triazine.

Molecular Properties

Compound Nameethoxyethane;1,3,5-triazine
PubChem CID69406478
Molecular FormulaC7H13N3O
Molecular Weight155.20 g/mol
Exact Mass155.11
IUPAC Nameethoxyethane;1,3,5-triazine
SMILESCCOCC.c1ncncn1
InChIInChI=1S/C4H10O.C3H3N3/c1-3-5-4-2;1-4-2-6-3-5-1/h3-4H2,1-2H3;1-3H
InChIKeyHSXDFSBJNZSIDJ-UHFFFAOYSA-N
XLogP0.91
TPSA47.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methoxy-1,3,5-triazine
CID 28657
2,4-Bis(2-methoxyethoxy)-1,3,5-triazine
CID 126305
6-Ethoxy-sym-triazine
CID 19751196
2,4-Diethoxy-1,3,5-triazine
CID 20062262
2-Methoxy-4-dimethylamino-1,3,5-triazine
CID 20209895
2-Fluoro-4-(2-methoxyethoxy)-1,3,5-triazine
CID 53852074
2-Ethoxy-4-fluoro-1,3,5-triazine
CID 54342791
2-(3-Fluoropropoxy)-1,3,5-triazine
CID 118039305
2-(2-Fluoroethoxy)-1,3,5-triazine
CID 141184343
4-Ethoxy-1,3,5-triazin-2-amine
CID 12234173
2-Chloro-4-(4-ethoxy)-1,3,5-triazine
CID 14993576
2-Propoxy-1,3,5-triazine
CID 19823942

Frequently Asked Questions

What is the IUPAC name of ethoxyethane;1,3,5-triazine?
The IUPAC name of ethoxyethane;1,3,5-triazine (CID 69406478) is ethoxyethane;1,3,5-triazine.
What is the SMILES notation for ethoxyethane;1,3,5-triazine?
The canonical SMILES for ethoxyethane;1,3,5-triazine is CCOCC.c1ncncn1.
What is the InChIKey of ethoxyethane;1,3,5-triazine?
The InChIKey is HSXDFSBJNZSIDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C3H3N3/c1-3-5-4-2;1-4-2-6-3-5-1/h3-4H2,1-2H3;1-3H.
What are the key properties of ethoxyethane;1,3,5-triazine?
ethoxyethane;1,3,5-triazine has a molecular weight of 155.20 g/mol, XLogP of 0.91, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;1,3,5-triazine is sourced from PubChem (CID 69406478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).