2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine

C7H16N6O3 — CID 67847762

IUPAC2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine
SMILESNc1nc(N)nc(N)n1.OCCOCCO
InChIInChI=1S/C4H10O3.C3H6N6/c5-1-3-7-4-2-6;4-1-7-2(5)9-3(6)8-1/h5-6H,1-4H2;(H6,4,5,6,7,8,9)
InChIKeyZOVZEPZXPRTIQO-UHFFFAOYSA-N
MW232.24 g/mol
LogP-2.39
Rot. Bonds4

About 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine

2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine (PubChem CID 67847762) has the molecular formula C7H16N6O3 and a molecular weight of 232.24 g/mol. Its IUPAC name is 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine
PubChem CID67847762
Molecular FormulaC7H16N6O3
Molecular Weight232.24 g/mol
Exact Mass232.13
IUPAC Name2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine
SMILESNc1nc(N)nc(N)n1.OCCOCCO
InChIInChI=1S/C4H10O3.C3H6N6/c5-1-3-7-4-2-6;4-1-7-2(5)9-3(6)8-1/h5-6H,1-4H2;(H6,4,5,6,7,8,9)
InChIKeyZOVZEPZXPRTIQO-UHFFFAOYSA-N
XLogP-2.39
TPSA166.42 Ų
H-Bond Donors5
H-Bond Acceptors9
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.24
LogP ≤ 5-2.39
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine (CID 67847762) is 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine is Nc1nc(N)nc(N)n1.OCCOCCO.
What is the InChIKey of 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine?
The InChIKey is ZOVZEPZXPRTIQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O3.C3H6N6/c5-1-3-7-4-2-6;4-1-7-2(5)9-3(6)8-1/h5-6H,1-4H2;(H6,4,5,6,7,8,9).
What are the key properties of 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine?
2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine has a molecular weight of 232.24 g/mol, XLogP of -2.39, 4 rotatable bonds, 5 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethoxy)ethanol;1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 67847762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).