5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine

C5H8N2OS — CID 55285026

IUPAC5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine
SMILESCSc1c(N)noc1C
InChIInChI=1S/C5H8N2OS/c1-3-4(9-2)5(6)7-8-3/h1-2H3,(H2,6,7)
InChIKeyKAXHZFXZBKPVSW-UHFFFAOYSA-N
MW144.20 g/mol
LogP1.29
Rot. Bonds1

About 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine

5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine (PubChem CID 55285026) has the molecular formula C5H8N2OS and a molecular weight of 144.20 g/mol. Its IUPAC name is 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine
PubChem CID55285026
Molecular FormulaC5H8N2OS
Molecular Weight144.20 g/mol
Exact Mass144.04
IUPAC Name5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine
SMILESCSc1c(N)noc1C
InChIInChI=1S/C5H8N2OS/c1-3-4(9-2)5(6)7-8-3/h1-2H3,(H2,6,7)
InChIKeyKAXHZFXZBKPVSW-UHFFFAOYSA-N
XLogP1.29
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.20
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-5-methyl-1,2-oxazole-4-carboxamide
CID 118920356
3-(4-methoxyphenyl)-5-methyl-4-methylsulfanyl-1,2-oxazole
CID 68883545
2-(3-amino-5-methyl-1,2-oxazol-4-yl)ethanol
CID 129320159
5-methyl-4-(2-methylpropyl)-1,2-oxazol-3-amine
CID 66199654
methyl 3-amino-5-methyl-1,2-oxazole-4-sulfinate
CID 18741337
4-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazol-3-amine
CID 66200303
4-(3,4-dimethylphenyl)-5-methyl-1,2-oxazol-3-amine
CID 66201499
4-(4-methylphenyl)-5-(4-methylsulfanylphenyl)-1,2-oxazol-3-amine
CID 79212754
4-(2,4-dimethylphenyl)-5-methyl-1,2-oxazol-3-amine
CID 82469635
4-(3-aminophenyl)-5-methyl-1,2-oxazol-3-amine
CID 90655987
4-methyl-5-(methylsulfonylmethyl)-1,2-oxazol-3-amine
CID 66199398
4-methyl-[1,2]oxazolo[5,4-b]pyridin-3-amine
CID 79002352

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine?
The IUPAC name of 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine (CID 55285026) is 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine.
What is the SMILES notation for 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine?
The canonical SMILES for 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine is CSc1c(N)noc1C.
What is the InChIKey of 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine?
The InChIKey is KAXHZFXZBKPVSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2OS/c1-3-4(9-2)5(6)7-8-3/h1-2H3,(H2,6,7).
What are the key properties of 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine?
5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine has a molecular weight of 144.20 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-methylsulfanyl-1,2-oxazol-3-amine is sourced from PubChem (CID 55285026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).