4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine

C9H16N4O — CID 23295

IUPAC4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine
SMILESCCNc1nc(CC)nc(OCC)n1
InChIInChI=1S/C9H16N4O/c1-4-7-11-8(10-5-2)13-9(12-7)14-6-3/h4-6H2,1-3H3,(H,10,11,12,13)
InChIKeyOBDQAMHBCJKXJD-UHFFFAOYSA-N
MW196.25 g/mol
LogP1.26
Rot. Bonds5

About 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine

4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine (PubChem CID 23295) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine
PubChem CID23295
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine
SMILESCCNc1nc(CC)nc(OCC)n1
InChIInChI=1S/C9H16N4O/c1-4-7-11-8(10-5-2)13-9(12-7)14-6-3/h4-6H2,1-3H3,(H,10,11,12,13)
InChIKeyOBDQAMHBCJKXJD-UHFFFAOYSA-N
XLogP1.26
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine (CID 23295) is 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine is CCNc1nc(CC)nc(OCC)n1.
What is the InChIKey of 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine?
The InChIKey is OBDQAMHBCJKXJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c1-4-7-11-8(10-5-2)13-9(12-7)14-6-3/h4-6H2,1-3H3,(H,10,11,12,13).
What are the key properties of 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine?
4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine has a molecular weight of 196.25 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N,6-diethyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 23295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).