3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine

C6H10N6O — CID 69255677

IUPAC3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine
SMILESCCOn1cnc2c(N)nc(N)n21
InChIInChI=1S/C6H10N6O/c1-2-13-11-3-9-5-4(7)10-6(8)12(5)11/h3H,2,7H2,1H3,(H2,8,10)
InChIKeyDQSOYDMQWOWKRN-UHFFFAOYSA-N
MW182.19 g/mol
LogP-0.86
Rot. Bonds2

About 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine

3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine (PubChem CID 69255677) has the molecular formula C6H10N6O and a molecular weight of 182.19 g/mol. Its IUPAC name is 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine.

Molecular Properties

Compound Name3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine
PubChem CID69255677
Molecular FormulaC6H10N6O
Molecular Weight182.19 g/mol
Exact Mass182.09
IUPAC Name3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine
SMILESCCOn1cnc2c(N)nc(N)n21
InChIInChI=1S/C6H10N6O/c1-2-13-11-3-9-5-4(7)10-6(8)12(5)11/h3H,2,7H2,1H3,(H2,8,10)
InChIKeyDQSOYDMQWOWKRN-UHFFFAOYSA-N
XLogP-0.86
TPSA96.39 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 5-0.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

1-ethoxyimidazo[1,5-c]triazole-4,6-diamine
CID 69255028
2-(7-aminoimidazo[1,5-b][1,2,4]triazol-3-yl)oxyethanol
CID 69255488
1-ethoxyimidazo[1,5-b]pyrazole-2,6-diamine
CID 69254723
1-ethoxy-2,3-dimethylimidazo[1,5-a]imidazol-7-amine
CID 69459147
2-amino-7-ethoxy-1-methylpurin-6-one
CID 67811579
1-ethoxypyrazolo[1,5-b]pyrazol-4-amine
CID 69255460
3,5-diethoxypyridine-2,6-diamine;dihydrochloride
CID 70442489
1-ethoxy-6-ethyl-3-methoxypyrazolo[3,4-d]pyrimidin-4-amine
CID 67144529
1-ethoxypyrrole-2,3-diamine
CID 55284781
1-(4-ethoxyphenyl)-3-N,3-N-dimethyl-1,2,4-triazole-3,5-diamine
CID 107958243
2-amino-1-ethoxy-7H-purin-6-one
CID 174590702
9-(3-ethoxypropoxy)purin-2-amine
CID 10105575

Frequently Asked Questions

What is the IUPAC name of 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine?
The IUPAC name of 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine (CID 69255677) is 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine.
What is the SMILES notation for 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine?
The canonical SMILES for 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine is CCOn1cnc2c(N)nc(N)n21.
What is the InChIKey of 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine?
The InChIKey is DQSOYDMQWOWKRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N6O/c1-2-13-11-3-9-5-4(7)10-6(8)12(5)11/h3H,2,7H2,1H3,(H2,8,10).
What are the key properties of 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine?
3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine has a molecular weight of 182.19 g/mol, XLogP of -0.86, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxyimidazo[1,5-b][1,2,4]triazole-5,7-diamine is sourced from PubChem (CID 69255677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).