8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one

C11H16N4O — CID 13177016

IUPAC8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one
SMILESCCCc1nc(CC)c2c(C)n[nH]c(=O)n12
InChIInChI=1S/C11H16N4O/c1-4-6-9-12-8(5-2)10-7(3)13-14-11(16)15(9)10/h4-6H2,1-3H3,(H,14,16)
InChIKeyFERLZMFEVILBEN-UHFFFAOYSA-N
MW220.28 g/mol
LogP1.24
Rot. Bonds3

About 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one

8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one (PubChem CID 13177016) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one.

Molecular Properties

Compound Name8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one
PubChem CID13177016
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one
SMILESCCCc1nc(CC)c2c(C)n[nH]c(=O)n12
InChIInChI=1S/C11H16N4O/c1-4-6-9-12-8(5-2)10-7(3)13-14-11(16)15(9)10/h4-6H2,1-3H3,(H,14,16)
InChIKeyFERLZMFEVILBEN-UHFFFAOYSA-N
XLogP1.24
TPSA63.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one?
The IUPAC name of 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one (CID 13177016) is 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one.
What is the SMILES notation for 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one?
The canonical SMILES for 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one is CCCc1nc(CC)c2c(C)n[nH]c(=O)n12.
What is the InChIKey of 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one?
The InChIKey is FERLZMFEVILBEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-4-6-9-12-8(5-2)10-7(3)13-14-11(16)15(9)10/h4-6H2,1-3H3,(H,14,16).
What are the key properties of 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one?
8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one has a molecular weight of 220.28 g/mol, XLogP of 1.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-1-methyl-6-propyl-3H-imidazo[1,5-d][1,2,4]triazin-4-one is sourced from PubChem (CID 13177016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).