O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine

C12H17N7O — CID 159814805

IUPACO-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCON.Nc1ccccn1.Nc1nc2ccccn2n1
InChIInChI=1S/C6H6N4.C5H6N2.CH5NO/c7-6-8-5-3-1-2-4-10(5)9-6;6-5-3-1-2-4-7-5;1-3-2/h1-4H,(H2,7,9);1-4H,(H2,6,7);2H2,1H3
InChIKeyNLMCUTAXPDXBBD-UHFFFAOYSA-N
MW275.32 g/mol
LogP0.48
Rot. Bonds

About O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine

O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 159814805) has the molecular formula C12H17N7O and a molecular weight of 275.32 g/mol. Its IUPAC name is O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound NameO-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID159814805
Molecular FormulaC12H17N7O
Molecular Weight275.32 g/mol
Exact Mass275.15
IUPAC NameO-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCON.Nc1ccccn1.Nc1nc2ccccn2n1
InChIInChI=1S/C6H6N4.C5H6N2.CH5NO/c7-6-8-5-3-1-2-4-10(5)9-6;6-5-3-1-2-4-7-5;1-3-2/h1-4H,(H2,7,9);1-4H,(H2,6,7);2H2,1H3
InChIKeyNLMCUTAXPDXBBD-UHFFFAOYSA-N
XLogP0.48
TPSA130.37 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.32
LogP ≤ 50.48
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 159814805) is O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine is CON.Nc1ccccn1.Nc1nc2ccccn2n1.
What is the InChIKey of O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is NLMCUTAXPDXBBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4.C5H6N2.CH5NO/c7-6-8-5-3-1-2-4-10(5)9-6;6-5-3-1-2-4-7-5;1-3-2/h1-4H,(H2,7,9);1-4H,(H2,6,7);2H2,1H3.
What are the key properties of O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine?
O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 275.32 g/mol, XLogP of 0.48, 0 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for O-methylhydroxylamine;pyridin-2-amine;[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 159814805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).