ethoxyethane;1,3,5-triazine-2,4,6-triamine

C7H16N6O — CID 22177331

IUPACethoxyethane;1,3,5-triazine-2,4,6-triamine
SMILESCCOCC.Nc1nc(N)nc(N)n1
InChIInChI=1S/C4H10O.C3H6N6/c1-3-5-4-2;4-1-7-2(5)9-3(6)8-1/h3-4H2,1-2H3;(H6,4,5,6,7,8,9)
InChIKeyJCDDIPNPVWTLJY-UHFFFAOYSA-N
MW200.25 g/mol
LogP-0.34
Rot. Bonds2

About ethoxyethane;1,3,5-triazine-2,4,6-triamine

ethoxyethane;1,3,5-triazine-2,4,6-triamine (PubChem CID 22177331) has the molecular formula C7H16N6O and a molecular weight of 200.25 g/mol. Its IUPAC name is ethoxyethane;1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Nameethoxyethane;1,3,5-triazine-2,4,6-triamine
PubChem CID22177331
Molecular FormulaC7H16N6O
Molecular Weight200.25 g/mol
Exact Mass200.14
IUPAC Nameethoxyethane;1,3,5-triazine-2,4,6-triamine
SMILESCCOCC.Nc1nc(N)nc(N)n1
InChIInChI=1S/C4H10O.C3H6N6/c1-3-5-4-2;4-1-7-2(5)9-3(6)8-1/h3-4H2,1-2H3;(H6,4,5,6,7,8,9)
InChIKeyJCDDIPNPVWTLJY-UHFFFAOYSA-N
XLogP-0.34
TPSA125.96 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.25
LogP ≤ 5-0.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of ethoxyethane;1,3,5-triazine-2,4,6-triamine?
The IUPAC name of ethoxyethane;1,3,5-triazine-2,4,6-triamine (CID 22177331) is ethoxyethane;1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for ethoxyethane;1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for ethoxyethane;1,3,5-triazine-2,4,6-triamine is CCOCC.Nc1nc(N)nc(N)n1.
What is the InChIKey of ethoxyethane;1,3,5-triazine-2,4,6-triamine?
The InChIKey is JCDDIPNPVWTLJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.C3H6N6/c1-3-5-4-2;4-1-7-2(5)9-3(6)8-1/h3-4H2,1-2H3;(H6,4,5,6,7,8,9).
What are the key properties of ethoxyethane;1,3,5-triazine-2,4,6-triamine?
ethoxyethane;1,3,5-triazine-2,4,6-triamine has a molecular weight of 200.25 g/mol, XLogP of -0.34, 2 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for ethoxyethane;1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 22177331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).