2-methyl-1,3-oxazol-5-amine

C4H6N2O — CID 69158971

IUPAC2-methyl-1,3-oxazol-5-amine
SMILESCc1ncc(N)o1
InChIInChI=1S/C4H6N2O/c1-3-6-2-4(5)7-3/h2H,5H2,1H3
InChIKeyKTCSSHMFUICZRA-UHFFFAOYSA-N
MW98.10 g/mol
LogP0.57
Rot. Bonds

About 2-methyl-1,3-oxazol-5-amine

2-methyl-1,3-oxazol-5-amine (PubChem CID 69158971) has the molecular formula C4H6N2O and a molecular weight of 98.10 g/mol. Its IUPAC name is 2-methyl-1,3-oxazol-5-amine.

Molecular Properties

Compound Name2-methyl-1,3-oxazol-5-amine
PubChem CID69158971
Molecular FormulaC4H6N2O
Molecular Weight98.10 g/mol
Exact Mass98.05
IUPAC Name2-methyl-1,3-oxazol-5-amine
SMILESCc1ncc(N)o1
InChIInChI=1S/C4H6N2O/c1-3-6-2-4(5)7-3/h2H,5H2,1H3
InChIKeyKTCSSHMFUICZRA-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 2-methyl-1,3-oxazol-5-amine?
The IUPAC name of 2-methyl-1,3-oxazol-5-amine (CID 69158971) is 2-methyl-1,3-oxazol-5-amine.
What is the SMILES notation for 2-methyl-1,3-oxazol-5-amine?
The canonical SMILES for 2-methyl-1,3-oxazol-5-amine is Cc1ncc(N)o1.
What is the InChIKey of 2-methyl-1,3-oxazol-5-amine?
The InChIKey is KTCSSHMFUICZRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6N2O/c1-3-6-2-4(5)7-3/h2H,5H2,1H3.
What are the key properties of 2-methyl-1,3-oxazol-5-amine?
2-methyl-1,3-oxazol-5-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 2-methyl-1,3-oxazol-5-amine is sourced from PubChem (CID 69158971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).