O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine

C9H18N2O — CID 168995818

IUPACO-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine
SMILESNOCC1(CN2CCCC2)CC1
InChIInChI=1S/C9H18N2O/c10-12-8-9(3-4-9)7-11-5-1-2-6-11/h1-8,10H2
InChIKeyVEFJXLBIFCWVTC-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.75
Rot. Bonds4

About O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine

O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine (PubChem CID 168995818) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine.

Molecular Properties

Compound NameO-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine
PubChem CID168995818
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameO-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine
SMILESNOCC1(CN2CCCC2)CC1
InChIInChI=1S/C9H18N2O/c10-12-8-9(3-4-9)7-11-5-1-2-6-11/h1-8,10H2
InChIKeyVEFJXLBIFCWVTC-UHFFFAOYSA-N
XLogP0.75
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.75
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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Related Compounds

[1-(Pyrrolidin-1-ylmethyl)cyclopropyl]methyl hypofluorite
CID 164878789
1-[[1-(Methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 142524145
1,1-dimethylcyclopropane;N-(3-pyrrolidin-1-ylpropoxy)methanamine
CID 153375971
[1-(Pyrrolidin-1-ylmethyl)cyclopropyl]methyl hypoiodite
CID 156062090
Ethane;1-[[1-(methoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 164878446
O-[[1-[(2-methylpyrrolidin-1-yl)methyl]cyclopropyl]methyl]hydroxylamine
CID 164878454
Potassium [1-(pyrrolidin-1-ylmethyl)cyclopropyl]methanolate
CID 166533358
N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methoxy]methanamine
CID 166533410
O-[[1-[(dimethylamino)methyl]cyclopropyl]methyl]hydroxylamine
CID 166533640
Potassium;ethane;[1-[(3-methylpyrrolidin-1-yl)methyl]cyclopropyl]methanolate
CID 169255728
1-[[1-(Ethoxymethyl)cyclopropyl]methyl]pyrrolidine
CID 169996619
[1-(Pyrrolidin-1-ylmethyl)cyclopropyl]methyl hypofluorite;hydrofluoride
CID 170572346

Frequently Asked Questions

What is the IUPAC name of O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine?
The IUPAC name of O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine (CID 168995818) is O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine.
What is the SMILES notation for O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine?
The canonical SMILES for O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine is NOCC1(CN2CCCC2)CC1.
What is the InChIKey of O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine?
The InChIKey is VEFJXLBIFCWVTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c10-12-8-9(3-4-9)7-11-5-1-2-6-11/h1-8,10H2.
What are the key properties of O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine?
O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine has a molecular weight of 170.26 g/mol, XLogP of 0.75, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]hydroxylamine is sourced from PubChem (CID 168995818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).