O-[(6-amino-3-pyridinyl)methyl]hydroxylamine

C6H9N3O — CID 45079509

IUPACO-[(6-amino-3-pyridinyl)methyl]hydroxylamine
SMILESNOCc1ccc(N)nc1
InChIInChI=1S/C6H9N3O/c7-6-2-1-5(3-9-6)4-10-8/h1-3H,4,8H2,(H2,7,9)
InChIKeyLOEVBIUKXXAICH-UHFFFAOYSA-N
MW139.16 g/mol
LogP0.05
Rot. Bonds2

About O-[(6-amino-3-pyridinyl)methyl]hydroxylamine

O-[(6-amino-3-pyridinyl)methyl]hydroxylamine (PubChem CID 45079509) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is O-[(6-amino-3-pyridinyl)methyl]hydroxylamine.

Molecular Properties

Compound NameO-[(6-amino-3-pyridinyl)methyl]hydroxylamine
PubChem CID45079509
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC NameO-[(6-amino-3-pyridinyl)methyl]hydroxylamine
SMILESNOCc1ccc(N)nc1
InChIInChI=1S/C6H9N3O/c7-6-2-1-5(3-9-6)4-10-8/h1-3H,4,8H2,(H2,7,9)
InChIKeyLOEVBIUKXXAICH-UHFFFAOYSA-N
XLogP0.05
TPSA74.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 50.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[(6-amino-3-pyridinyl)methyl]hydroxylamine?
The IUPAC name of O-[(6-amino-3-pyridinyl)methyl]hydroxylamine (CID 45079509) is O-[(6-amino-3-pyridinyl)methyl]hydroxylamine.
What is the SMILES notation for O-[(6-amino-3-pyridinyl)methyl]hydroxylamine?
The canonical SMILES for O-[(6-amino-3-pyridinyl)methyl]hydroxylamine is NOCc1ccc(N)nc1.
What is the InChIKey of O-[(6-amino-3-pyridinyl)methyl]hydroxylamine?
The InChIKey is LOEVBIUKXXAICH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N3O/c7-6-2-1-5(3-9-6)4-10-8/h1-3H,4,8H2,(H2,7,9).
What are the key properties of O-[(6-amino-3-pyridinyl)methyl]hydroxylamine?
O-[(6-amino-3-pyridinyl)methyl]hydroxylamine has a molecular weight of 139.16 g/mol, XLogP of 0.05, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[(6-amino-3-pyridinyl)methyl]hydroxylamine is sourced from PubChem (CID 45079509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).