O-cyclopropylhydroxylamine;1-methylpyrrolidine

C8H18N2O — CID 166533297

IUPACO-cyclopropylhydroxylamine;1-methylpyrrolidine
SMILESCN1CCCC1.NOC1CC1
InChIInChI=1S/C5H11N.C3H7NO/c1-6-4-2-3-5-6;4-5-3-1-2-3/h2-5H2,1H3;3H,1-2,4H2
InChIKeyOTBSJBDEPVAORL-UHFFFAOYSA-N
MW158.24 g/mol
LogP0.75
Rot. Bonds1

About O-cyclopropylhydroxylamine;1-methylpyrrolidine

O-cyclopropylhydroxylamine;1-methylpyrrolidine (PubChem CID 166533297) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is O-cyclopropylhydroxylamine;1-methylpyrrolidine.

Molecular Properties

Compound NameO-cyclopropylhydroxylamine;1-methylpyrrolidine
PubChem CID166533297
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC NameO-cyclopropylhydroxylamine;1-methylpyrrolidine
SMILESCN1CCCC1.NOC1CC1
InChIInChI=1S/C5H11N.C3H7NO/c1-6-4-2-3-5-6;4-5-3-1-2-3/h2-5H2,1H3;3H,1-2,4H2
InChIKeyOTBSJBDEPVAORL-UHFFFAOYSA-N
XLogP0.75
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
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

O-(1-propylpyrrolidin-3-yl)hydroxylamine
CID 84107100
Ethane;methoxycyclopropane;1-methylpyrrolidine
CID 164878360
N-cyclopropyloxymethanamine;1-methylpyrrolidine
CID 166533188
1-methylpyrrolidine;N-propan-2-yloxymethanamine
CID 166533682
1-methylpyrrolidine;O-propan-2-ylhydroxylamine
CID 166533947
O-cyclopropylhydroxylamine;ethane;1-methylpyrrolidine
CID 166533960
ethane;1-methylpyrrolidine;O-propan-2-ylhydroxylamine
CID 169182154
O-(1-butylpyrrolidin-3-yl)hydroxylamine
CID 84107730
O-[4-(pyrrolidin-1-yl)butan-2-yl]hydroxylamine
CID 165681367

Frequently Asked Questions

What is the IUPAC name of O-cyclopropylhydroxylamine;1-methylpyrrolidine?
The IUPAC name of O-cyclopropylhydroxylamine;1-methylpyrrolidine (CID 166533297) is O-cyclopropylhydroxylamine;1-methylpyrrolidine.
What is the SMILES notation for O-cyclopropylhydroxylamine;1-methylpyrrolidine?
The canonical SMILES for O-cyclopropylhydroxylamine;1-methylpyrrolidine is CN1CCCC1.NOC1CC1.
What is the InChIKey of O-cyclopropylhydroxylamine;1-methylpyrrolidine?
The InChIKey is OTBSJBDEPVAORL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.C3H7NO/c1-6-4-2-3-5-6;4-5-3-1-2-3/h2-5H2,1H3;3H,1-2,4H2.
What are the key properties of O-cyclopropylhydroxylamine;1-methylpyrrolidine?
O-cyclopropylhydroxylamine;1-methylpyrrolidine has a molecular weight of 158.24 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-cyclopropylhydroxylamine;1-methylpyrrolidine is sourced from PubChem (CID 166533297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).