O-(3-methyl-2-pyridinyl)hydroxylamine

C6H8N2O — CID 79422028

IUPACO-(3-methyl-2-pyridinyl)hydroxylamine
SMILESCc1cccnc1ON
InChIInChI=1S/C6H8N2O/c1-5-3-2-4-8-6(5)9-7/h2-4H,7H2,1H3
InChIKeySCFWPBNXBHJUKX-UHFFFAOYSA-N
MW124.14 g/mol
LogP0.64
Rot. Bonds1

About O-(3-methyl-2-pyridinyl)hydroxylamine

O-(3-methyl-2-pyridinyl)hydroxylamine (PubChem CID 79422028) has the molecular formula C6H8N2O and a molecular weight of 124.14 g/mol. Its IUPAC name is O-(3-methyl-2-pyridinyl)hydroxylamine.

Molecular Properties

Compound NameO-(3-methyl-2-pyridinyl)hydroxylamine
PubChem CID79422028
Molecular FormulaC6H8N2O
Molecular Weight124.14 g/mol
Exact Mass124.06
IUPAC NameO-(3-methyl-2-pyridinyl)hydroxylamine
SMILESCc1cccnc1ON
InChIInChI=1S/C6H8N2O/c1-5-3-2-4-8-6(5)9-7/h2-4H,7H2,1H3
InChIKeySCFWPBNXBHJUKX-UHFFFAOYSA-N
XLogP0.64
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.14
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze O-(3-methyl-2-pyridinyl)hydroxylamine 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 O-(3-methyl-2-pyridinyl)hydroxylamine?
The IUPAC name of O-(3-methyl-2-pyridinyl)hydroxylamine (CID 79422028) is O-(3-methyl-2-pyridinyl)hydroxylamine.
What is the SMILES notation for O-(3-methyl-2-pyridinyl)hydroxylamine?
The canonical SMILES for O-(3-methyl-2-pyridinyl)hydroxylamine is Cc1cccnc1ON.
What is the InChIKey of O-(3-methyl-2-pyridinyl)hydroxylamine?
The InChIKey is SCFWPBNXBHJUKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O/c1-5-3-2-4-8-6(5)9-7/h2-4H,7H2,1H3.
What are the key properties of O-(3-methyl-2-pyridinyl)hydroxylamine?
O-(3-methyl-2-pyridinyl)hydroxylamine has a molecular weight of 124.14 g/mol, XLogP of 0.64, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(3-methyl-2-pyridinyl)hydroxylamine is sourced from PubChem (CID 79422028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).