2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one

C11H19N5O — CID 610464

IUPAC2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one
SMILESCCN(CC)c1nc2n(c(=O)n1)CCN2CC
InChIInChI=1S/C11H19N5O/c1-4-14(5-2)9-12-10-15(6-3)7-8-16(10)11(17)13-9/h4-8H2,1-3H3
InChIKeyZZGGEPQSJVNVRQ-UHFFFAOYSA-N
MW237.31 g/mol
LogP0.32
Rot. Bonds4

About 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one

2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one (PubChem CID 610464) has the molecular formula C11H19N5O and a molecular weight of 237.31 g/mol. Its IUPAC name is 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one.

Molecular Properties

Compound Name2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one
PubChem CID610464
Molecular FormulaC11H19N5O
Molecular Weight237.31 g/mol
Exact Mass237.16
IUPAC Name2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one
SMILESCCN(CC)c1nc2n(c(=O)n1)CCN2CC
InChIInChI=1S/C11H19N5O/c1-4-14(5-2)9-12-10-15(6-3)7-8-16(10)11(17)13-9/h4-8H2,1-3H3
InChIKeyZZGGEPQSJVNVRQ-UHFFFAOYSA-N
XLogP0.32
TPSA54.26 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.31
LogP ≤ 50.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one?
The IUPAC name of 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one (CID 610464) is 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one.
What is the SMILES notation for 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one?
The canonical SMILES for 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one is CCN(CC)c1nc2n(c(=O)n1)CCN2CC.
What is the InChIKey of 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one?
The InChIKey is ZZGGEPQSJVNVRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5O/c1-4-14(5-2)9-12-10-15(6-3)7-8-16(10)11(17)13-9/h4-8H2,1-3H3.
What are the key properties of 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one?
2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one has a molecular weight of 237.31 g/mol, XLogP of 0.32, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-8-ethyl-6,7-dihydroimidazo[1,2-a][1,3,5]triazin-4-one is sourced from PubChem (CID 610464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).