6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine

C6H10N4O — CID 75355410

IUPAC6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine
SMILESNCc1nnc2n1CCOC2
InChIInChI=1S/C6H10N4O/c7-3-5-8-9-6-4-11-2-1-10(5)6/h1-4,7H2
InChIKeyMHOICHGGHLYUIK-UHFFFAOYSA-N
MW154.17 g/mol
LogP-0.73
Rot. Bonds1

About 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine

6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine (PubChem CID 75355410) has the molecular formula C6H10N4O and a molecular weight of 154.17 g/mol. Its IUPAC name is 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine.

Molecular Properties

Compound Name6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine
PubChem CID75355410
Molecular FormulaC6H10N4O
Molecular Weight154.17 g/mol
Exact Mass154.09
IUPAC Name6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine
SMILESNCc1nnc2n1CCOC2
InChIInChI=1S/C6H10N4O/c7-3-5-8-9-6-4-11-2-1-10(5)6/h1-4,7H2
InChIKeyMHOICHGGHLYUIK-UHFFFAOYSA-N
XLogP-0.73
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.17
LogP ≤ 5-0.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine?
The IUPAC name of 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine (CID 75355410) is 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine.
What is the SMILES notation for 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine?
The canonical SMILES for 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine is NCc1nnc2n1CCOC2.
What is the InChIKey of 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine?
The InChIKey is MHOICHGGHLYUIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O/c7-3-5-8-9-6-4-11-2-1-10(5)6/h1-4,7H2.
What are the key properties of 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine?
6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine has a molecular weight of 154.17 g/mol, XLogP of -0.73, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dihydro-5H-[1,2,4]triazolo[3,4-c][1,4]oxazin-3-ylmethanamine is sourced from PubChem (CID 75355410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).