2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine

C8H11N3O3 — CID 175338908

IUPAC2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine
SMILESc1ncnc(OCCOCC2CO2)n1
InChIInChI=1S/C8H11N3O3/c1(12-3-7-4-14-7)2-13-8-10-5-9-6-11-8/h5-7H,1-4H2
InChIKeyREAPBFHCDMQAEQ-UHFFFAOYSA-N
MW197.19 g/mol
LogP-0.33
Rot. Bonds6

About 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine

2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine (PubChem CID 175338908) has the molecular formula C8H11N3O3 and a molecular weight of 197.19 g/mol. Its IUPAC name is 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine.

Molecular Properties

Compound Name2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine
PubChem CID175338908
Molecular FormulaC8H11N3O3
Molecular Weight197.19 g/mol
Exact Mass197.08
IUPAC Name2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine
SMILESc1ncnc(OCCOCC2CO2)n1
InChIInChI=1S/C8H11N3O3/c1(12-3-7-4-14-7)2-13-8-10-5-9-6-11-8/h5-7H,1-4H2
InChIKeyREAPBFHCDMQAEQ-UHFFFAOYSA-N
XLogP-0.33
TPSA69.66 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.19
LogP ≤ 5-0.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Related Compounds

2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 58765936
2-(2-methoxyethoxy)-1,3,5-triazine
CID 154184593
2-[2-(oxiran-2-ylmethoxy)ethoxymethyl]oxirane;2-[[4-(oxiran-2-ylmethoxy)phenoxy]methyl]oxirane
CID 146313445
2-[2-[4-[4-[2-(oxiran-2-ylmethoxy)ethoxy]phenyl]phenoxy]ethoxymethyl]oxirane
CID 87441812
2-[2-(2-phenoxyethoxy)ethoxymethyl]oxirane
CID 59687579
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 90384181
2-[2-(1,3,5-triazin-2-yloxy)ethoxy]ethanol
CID 175603748
2-[2-[4-[4-[2-(oxiran-2-ylmethoxy)ethoxy]phenyl]sulfanylphenoxy]ethoxymethyl]oxirane
CID 143216259
2-[2-(2-methylphenoxy)ethoxymethyl]oxirane
CID 13013247
2-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[3-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(oxiran-2-ylmethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxy]propoxymethyl]oxirane
CID 91036446
O-[2-(oxiran-2-ylmethoxy)ethyl]hydroxylamine
CID 163419249
CID 57064791
CID 57064791

Frequently Asked Questions

What is the IUPAC name of 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine?
The IUPAC name of 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine (CID 175338908) is 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine.
What is the SMILES notation for 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine?
The canonical SMILES for 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine is c1ncnc(OCCOCC2CO2)n1.
What is the InChIKey of 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine?
The InChIKey is REAPBFHCDMQAEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O3/c1(12-3-7-4-14-7)2-13-8-10-5-9-6-11-8/h5-7H,1-4H2.
What are the key properties of 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine?
2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine has a molecular weight of 197.19 g/mol, XLogP of -0.33, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(oxiran-2-ylmethoxy)ethoxy]-1,3,5-triazine is sourced from PubChem (CID 175338908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).