N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine

C5H8N2O2 — CID 82593723

IUPACN-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine
SMILESCN(O)Cc1cnco1
InChIInChI=1S/C5H8N2O2/c1-7(8)3-5-2-6-4-9-5/h2,4,8H,3H2,1H3
InChIKeyBSZGOFCTDGOEPY-UHFFFAOYSA-N
MW128.13 g/mol
LogP0.50
Rot. Bonds2

About N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine

N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine (PubChem CID 82593723) has the molecular formula C5H8N2O2 and a molecular weight of 128.13 g/mol. Its IUPAC name is N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine.

Molecular Properties

Compound NameN-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine
PubChem CID82593723
Molecular FormulaC5H8N2O2
Molecular Weight128.13 g/mol
Exact Mass128.06
IUPAC NameN-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine
SMILESCN(O)Cc1cnco1
InChIInChI=1S/C5H8N2O2/c1-7(8)3-5-2-6-4-9-5/h2,4,8H,3H2,1H3
InChIKeyBSZGOFCTDGOEPY-UHFFFAOYSA-N
XLogP0.50
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.13
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine?
The IUPAC name of N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine (CID 82593723) is N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine.
What is the SMILES notation for N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine?
The canonical SMILES for N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine is CN(O)Cc1cnco1.
What is the InChIKey of N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine?
The InChIKey is BSZGOFCTDGOEPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O2/c1-7(8)3-5-2-6-4-9-5/h2,4,8H,3H2,1H3.
What are the key properties of N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine?
N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine has a molecular weight of 128.13 g/mol, XLogP of 0.50, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1,3-oxazol-5-ylmethyl)hydroxylamine is sourced from PubChem (CID 82593723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).