O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine

C9H14N2O2 — CID 69456472

IUPACO-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine
SMILESCOCCc1cccc(CON)n1
InChIInChI=1S/C9H14N2O2/c1-12-6-5-8-3-2-4-9(11-8)7-13-10/h2-4H,5-7,10H2,1H3
InChIKeyZDKCCTMRCHKJME-UHFFFAOYSA-N
MW182.22 g/mol
LogP0.66
Rot. Bonds5

About O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine

O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine (PubChem CID 69456472) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine.

Molecular Properties

Compound NameO-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine
PubChem CID69456472
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC NameO-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine
SMILESCOCCc1cccc(CON)n1
InChIInChI=1S/C9H14N2O2/c1-12-6-5-8-3-2-4-9(11-8)7-13-10/h2-4H,5-7,10H2,1H3
InChIKeyZDKCCTMRCHKJME-UHFFFAOYSA-N
XLogP0.66
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 50.66
H-Bond Donors ≤ 51
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-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine?
The IUPAC name of O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine (CID 69456472) is O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine.
What is the SMILES notation for O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine?
The canonical SMILES for O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine is COCCc1cccc(CON)n1.
What is the InChIKey of O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine?
The InChIKey is ZDKCCTMRCHKJME-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-12-6-5-8-3-2-4-9(11-8)7-13-10/h2-4H,5-7,10H2,1H3.
What are the key properties of O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine?
O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine has a molecular weight of 182.22 g/mol, XLogP of 0.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for O-[[6-(2-methoxyethyl)-2-pyridinyl]methyl]hydroxylamine is sourced from PubChem (CID 69456472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).