O-(1-methylpyrrolidin-2-yl)hydroxylamine

C5H12N2O — CID 117126764

IUPACO-(1-methylpyrrolidin-2-yl)hydroxylamine
SMILESCN1CCCC1ON
InChIInChI=1S/C5H12N2O/c1-7-4-2-3-5(7)8-6/h5H,2-4,6H2,1H3
InChIKeyGOZWKLPFGPIGFM-UHFFFAOYSA-N
MW116.16 g/mol
LogP-0.07
Rot. Bonds1

About O-(1-methylpyrrolidin-2-yl)hydroxylamine

O-(1-methylpyrrolidin-2-yl)hydroxylamine (PubChem CID 117126764) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is O-(1-methylpyrrolidin-2-yl)hydroxylamine.

Molecular Properties

Compound NameO-(1-methylpyrrolidin-2-yl)hydroxylamine
PubChem CID117126764
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC NameO-(1-methylpyrrolidin-2-yl)hydroxylamine
SMILESCN1CCCC1ON
InChIInChI=1S/C5H12N2O/c1-7-4-2-3-5(7)8-6/h5H,2-4,6H2,1H3
InChIKeyGOZWKLPFGPIGFM-UHFFFAOYSA-N
XLogP-0.07
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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-(1-methylpyrrolidin-2-yl)hydroxylamine?
The IUPAC name of O-(1-methylpyrrolidin-2-yl)hydroxylamine (CID 117126764) is O-(1-methylpyrrolidin-2-yl)hydroxylamine.
What is the SMILES notation for O-(1-methylpyrrolidin-2-yl)hydroxylamine?
The canonical SMILES for O-(1-methylpyrrolidin-2-yl)hydroxylamine is CN1CCCC1ON.
What is the InChIKey of O-(1-methylpyrrolidin-2-yl)hydroxylamine?
The InChIKey is GOZWKLPFGPIGFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-7-4-2-3-5(7)8-6/h5H,2-4,6H2,1H3.
What are the key properties of O-(1-methylpyrrolidin-2-yl)hydroxylamine?
O-(1-methylpyrrolidin-2-yl)hydroxylamine has a molecular weight of 116.16 g/mol, XLogP of -0.07, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(1-methylpyrrolidin-2-yl)hydroxylamine is sourced from PubChem (CID 117126764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).