5-methyl-1,2-oxazol-4-amine

C4H6N2O — CID 13033202

IUPAC5-methyl-1,2-oxazol-4-amine
SMILESCc1oncc1N
InChIInChI=1S/C4H6N2O/c1-3-4(5)2-6-7-3/h2H,5H2,1H3
InChIKeyQGMHRTDVNDXDBB-UHFFFAOYSA-N
MW98.10 g/mol
LogP0.57
Rot. Bonds

About 5-methyl-1,2-oxazol-4-amine

5-methyl-1,2-oxazol-4-amine (PubChem CID 13033202) has the molecular formula C4H6N2O and a molecular weight of 98.10 g/mol. Its IUPAC name is 5-methyl-1,2-oxazol-4-amine.

Molecular Properties

Compound Name5-methyl-1,2-oxazol-4-amine
PubChem CID13033202
Molecular FormulaC4H6N2O
Molecular Weight98.10 g/mol
Exact Mass98.05
IUPAC Name5-methyl-1,2-oxazol-4-amine
SMILESCc1oncc1N
InChIInChI=1S/C4H6N2O/c1-3-4(5)2-6-7-3/h2H,5H2,1H3
InChIKeyQGMHRTDVNDXDBB-UHFFFAOYSA-N
XLogP0.57
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50098.10
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1,2-oxazol-4-amine?
The IUPAC name of 5-methyl-1,2-oxazol-4-amine (CID 13033202) is 5-methyl-1,2-oxazol-4-amine.
What is the SMILES notation for 5-methyl-1,2-oxazol-4-amine?
The canonical SMILES for 5-methyl-1,2-oxazol-4-amine is Cc1oncc1N.
What is the InChIKey of 5-methyl-1,2-oxazol-4-amine?
The InChIKey is QGMHRTDVNDXDBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2O/c1-3-4(5)2-6-7-3/h2H,5H2,1H3.
What are the key properties of 5-methyl-1,2-oxazol-4-amine?
5-methyl-1,2-oxazol-4-amine has a molecular weight of 98.10 g/mol, XLogP of 0.57, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1,2-oxazol-4-amine is sourced from PubChem (CID 13033202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).