4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine

C8H14N4O — CID 64534848

IUPAC4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine
SMILESCCOC(C)c1nc(C)nc(N)n1
InChIInChI=1S/C8H14N4O/c1-4-13-5(2)7-10-6(3)11-8(9)12-7/h5H,4H2,1-3H3,(H2,9,10,11,12)
InChIKeyWICNBYKPXYUQLU-UHFFFAOYSA-N
MW182.23 g/mol
LogP0.86
Rot. Bonds3

About 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine

4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine (PubChem CID 64534848) has the molecular formula C8H14N4O and a molecular weight of 182.23 g/mol. Its IUPAC name is 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine
PubChem CID64534848
Molecular FormulaC8H14N4O
Molecular Weight182.23 g/mol
Exact Mass182.12
IUPAC Name4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine
SMILESCCOC(C)c1nc(C)nc(N)n1
InChIInChI=1S/C8H14N4O/c1-4-13-5(2)7-10-6(3)11-8(9)12-7/h5H,4H2,1-3H3,(H2,9,10,11,12)
InChIKeyWICNBYKPXYUQLU-UHFFFAOYSA-N
XLogP0.86
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.23
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine (CID 64534848) is 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine is CCOC(C)c1nc(C)nc(N)n1.
What is the InChIKey of 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine?
The InChIKey is WICNBYKPXYUQLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O/c1-4-13-5(2)7-10-6(3)11-8(9)12-7/h5H,4H2,1-3H3,(H2,9,10,11,12).
What are the key properties of 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine?
4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine has a molecular weight of 182.23 g/mol, XLogP of 0.86, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethoxyethyl)-6-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 64534848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).