O-(pyrrolidin-2-ylmethyl)hydroxylamine

C5H12N2O — CID 52910992

IUPACO-(pyrrolidin-2-ylmethyl)hydroxylamine
SMILESNOCC1CCCN1
InChIInChI=1S/C5H12N2O/c6-8-4-5-2-1-3-7-5/h5,7H,1-4,6H2
InChIKeyUCVQCEOPTRBRCW-UHFFFAOYSA-N
MW116.16 g/mol
LogP-0.37
Rot. Bonds2

About O-(pyrrolidin-2-ylmethyl)hydroxylamine

O-(pyrrolidin-2-ylmethyl)hydroxylamine (PubChem CID 52910992) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is O-(pyrrolidin-2-ylmethyl)hydroxylamine.

Molecular Properties

Compound NameO-(pyrrolidin-2-ylmethyl)hydroxylamine
PubChem CID52910992
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC NameO-(pyrrolidin-2-ylmethyl)hydroxylamine
SMILESNOCC1CCCN1
InChIInChI=1S/C5H12N2O/c6-8-4-5-2-1-3-7-5/h5,7H,1-4,6H2
InChIKeyUCVQCEOPTRBRCW-UHFFFAOYSA-N
XLogP-0.37
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

(2S)-2-(methylperoxymethyl)pyrrolidine
CID 88881099
[(2S)-pyrrolidin-2-yl]methoxysilane
CID 123846708
(2R)-2-(methoxymethyl)pyrrolidine;molecular hydrogen;propane
CID 143635962
(2S)-2-(cyclopropylmethoxymethyl)pyrrolidine
CID 59651686
(2R)-2-(cyclopropylmethoxymethyl)pyrrolidine
CID 102820123
[(2S)-pyrrolidin-2-yl]methyl carbamate;hydrochloride
CID 139649266
pyrrolidin-2-ylmethyl carbonochloridate
CID 175149666
CID 18724132
CID 18724132
2-(ethoxymethyl)pyrrolidine;2-(methoxymethyl)pyrrolidine
CID 145216939
2-(4-methoxybutoxymethyl)pyrrolidine
CID 104648269
2-[(2-methylpropan-2-yl)oxymethyl]pyrrolidine
CID 20765506
(2S)-2-(propan-2-yloxymethyl)pyrrolidine
CID 28802468

Frequently Asked Questions

What is the IUPAC name of O-(pyrrolidin-2-ylmethyl)hydroxylamine?
The IUPAC name of O-(pyrrolidin-2-ylmethyl)hydroxylamine (CID 52910992) is O-(pyrrolidin-2-ylmethyl)hydroxylamine.
What is the SMILES notation for O-(pyrrolidin-2-ylmethyl)hydroxylamine?
The canonical SMILES for O-(pyrrolidin-2-ylmethyl)hydroxylamine is NOCC1CCCN1.
What is the InChIKey of O-(pyrrolidin-2-ylmethyl)hydroxylamine?
The InChIKey is UCVQCEOPTRBRCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c6-8-4-5-2-1-3-7-5/h5,7H,1-4,6H2.
What are the key properties of O-(pyrrolidin-2-ylmethyl)hydroxylamine?
O-(pyrrolidin-2-ylmethyl)hydroxylamine has a molecular weight of 116.16 g/mol, XLogP of -0.37, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(pyrrolidin-2-ylmethyl)hydroxylamine is sourced from PubChem (CID 52910992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).