2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine

C7H12N2O2 — CID 62544782

IUPAC2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine
SMILESCOCCNCc1ccon1
InChIInChI=1S/C7H12N2O2/c1-10-5-3-8-6-7-2-4-11-9-7/h2,4,8H,3,5-6H2,1H3
InChIKeyUKBAOMJMJZHXQV-UHFFFAOYSA-N
MW156.19 g/mol
LogP0.41
Rot. Bonds5

About 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine

2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine (PubChem CID 62544782) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine
PubChem CID62544782
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine
SMILESCOCCNCc1ccon1
InChIInChI=1S/C7H12N2O2/c1-10-5-3-8-6-7-2-4-11-9-7/h2,4,8H,3,5-6H2,1H3
InChIKeyUKBAOMJMJZHXQV-UHFFFAOYSA-N
XLogP0.41
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine?
The IUPAC name of 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine (CID 62544782) is 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine.
What is the SMILES notation for 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine?
The canonical SMILES for 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine is COCCNCc1ccon1.
What is the InChIKey of 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine?
The InChIKey is UKBAOMJMJZHXQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-10-5-3-8-6-7-2-4-11-9-7/h2,4,8H,3,5-6H2,1H3.
What are the key properties of 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine?
2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine has a molecular weight of 156.19 g/mol, XLogP of 0.41, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1,2-oxazol-3-ylmethyl)ethanamine is sourced from PubChem (CID 62544782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).