N-(oxiran-2-ylmethoxy)methanamine

C4H9NO2 — CID 154141939

IUPACN-(oxiran-2-ylmethoxy)methanamine
SMILESCNOCC1CO1
InChIInChI=1S/C4H9NO2/c1-5-7-3-4-2-6-4/h4-5H,2-3H2,1H3
InChIKeyGLJGOLNCFAQGQI-UHFFFAOYSA-N
MW103.12 g/mol
LogP-0.46
Rot. Bonds3

About N-(oxiran-2-ylmethoxy)methanamine

N-(oxiran-2-ylmethoxy)methanamine (PubChem CID 154141939) has the molecular formula C4H9NO2 and a molecular weight of 103.12 g/mol. Its IUPAC name is N-(oxiran-2-ylmethoxy)methanamine.

Molecular Properties

Compound NameN-(oxiran-2-ylmethoxy)methanamine
PubChem CID154141939
Molecular FormulaC4H9NO2
Molecular Weight103.12 g/mol
Exact Mass103.06
IUPAC NameN-(oxiran-2-ylmethoxy)methanamine
SMILESCNOCC1CO1
InChIInChI=1S/C4H9NO2/c1-5-7-3-4-2-6-4/h4-5H,2-3H2,1H3
InChIKeyGLJGOLNCFAQGQI-UHFFFAOYSA-N
XLogP-0.46
TPSA33.79 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500103.12
LogP ≤ 5-0.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl-tris(oxiran-2-ylmethoxy)silane
CID 22460133
1-methyliodanuidyl-N-(oxiran-2-ylmethoxy)methanamine
CID 163898090
dimethoxymethane;bis(2-(methoxymethyl)oxirane)
CID 159900039
diiodovanadium;2-(methoxymethyl)oxirane
CID 158509470
1-ethoxy-N-(oxiran-2-ylmethoxy)ethenamine
CID 57112600
methane;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 167637417
2-(methoxymethyl)oxirane;trimethoxysilane
CID 173003709
dimethoxysilane;2-(methoxymethyl)oxirane
CID 175354723
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxymethyl]oxirane
CID 90384181
2-(4-methoxybutoxymethyl)oxirane
CID 58151519
(2R)-2-(3-methoxypropoxymethyl)oxirane
CID 130493223
ethanol;2-(oxiran-2-ylmethoxymethyl)oxirane
CID 87071861

Frequently Asked Questions

What is the IUPAC name of N-(oxiran-2-ylmethoxy)methanamine?
The IUPAC name of N-(oxiran-2-ylmethoxy)methanamine (CID 154141939) is N-(oxiran-2-ylmethoxy)methanamine.
What is the SMILES notation for N-(oxiran-2-ylmethoxy)methanamine?
The canonical SMILES for N-(oxiran-2-ylmethoxy)methanamine is CNOCC1CO1.
What is the InChIKey of N-(oxiran-2-ylmethoxy)methanamine?
The InChIKey is GLJGOLNCFAQGQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9NO2/c1-5-7-3-4-2-6-4/h4-5H,2-3H2,1H3.
What are the key properties of N-(oxiran-2-ylmethoxy)methanamine?
N-(oxiran-2-ylmethoxy)methanamine has a molecular weight of 103.12 g/mol, XLogP of -0.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxiran-2-ylmethoxy)methanamine is sourced from PubChem (CID 154141939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).