O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine

C9H11N5O — CID 69011027

IUPACO-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine
SMILESNOCc1ccc(-n2ccc(N)n2)cn1
InChIInChI=1S/C9H11N5O/c10-9-3-4-14(13-9)8-2-1-7(6-15-11)12-5-8/h1-5H,6,11H2,(H2,10,13)
InChIKeyLYQOYBKYZMGIOK-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.24
Rot. Bonds3

About O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine

O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine (PubChem CID 69011027) has the molecular formula C9H11N5O and a molecular weight of 205.22 g/mol. Its IUPAC name is O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine.

Molecular Properties

Compound NameO-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine
PubChem CID69011027
Molecular FormulaC9H11N5O
Molecular Weight205.22 g/mol
Exact Mass205.10
IUPAC NameO-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine
SMILESNOCc1ccc(-n2ccc(N)n2)cn1
InChIInChI=1S/C9H11N5O/c10-9-3-4-14(13-9)8-2-1-7(6-15-11)12-5-8/h1-5H,6,11H2,(H2,10,13)
InChIKeyLYQOYBKYZMGIOK-UHFFFAOYSA-N
XLogP0.24
TPSA91.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]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-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine?
The IUPAC name of O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine (CID 69011027) is O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine.
What is the SMILES notation for O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine?
The canonical SMILES for O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine is NOCc1ccc(-n2ccc(N)n2)cn1.
What is the InChIKey of O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine?
The InChIKey is LYQOYBKYZMGIOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5O/c10-9-3-4-14(13-9)8-2-1-7(6-15-11)12-5-8/h1-5H,6,11H2,(H2,10,13).
What are the key properties of O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine?
O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine has a molecular weight of 205.22 g/mol, XLogP of 0.24, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for O-[[5-(3-aminopyrazol-1-yl)-2-pyridinyl]methyl]hydroxylamine is sourced from PubChem (CID 69011027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).