4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine

C7H7N3OS — CID 14814701

IUPAC4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine
SMILESCc1cc(-c2csc(N)n2)on1
InChIInChI=1S/C7H7N3OS/c1-4-2-6(11-10-4)5-3-12-7(8)9-5/h2-3H,1H3,(H2,8,9)
InChIKeyGGLUPOVMYMPJEB-UHFFFAOYSA-N
MW181.22 g/mol
LogP1.69
Rot. Bonds1

About 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine

4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine (PubChem CID 14814701) has the molecular formula C7H7N3OS and a molecular weight of 181.22 g/mol. Its IUPAC name is 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine.

Molecular Properties

Compound Name4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine
PubChem CID14814701
Molecular FormulaC7H7N3OS
Molecular Weight181.22 g/mol
Exact Mass181.03
IUPAC Name4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine
SMILESCc1cc(-c2csc(N)n2)on1
InChIInChI=1S/C7H7N3OS/c1-4-2-6(11-10-4)5-3-12-7(8)9-5/h2-3H,1H3,(H2,8,9)
InChIKeyGGLUPOVMYMPJEB-UHFFFAOYSA-N
XLogP1.69
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.22
LogP ≤ 51.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine?
The IUPAC name of 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine (CID 14814701) is 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine.
What is the SMILES notation for 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine?
The canonical SMILES for 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine is Cc1cc(-c2csc(N)n2)on1.
What is the InChIKey of 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine?
The InChIKey is GGLUPOVMYMPJEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3OS/c1-4-2-6(11-10-4)5-3-12-7(8)9-5/h2-3H,1H3,(H2,8,9).
What are the key properties of 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine?
4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine has a molecular weight of 181.22 g/mol, XLogP of 1.69, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-methyl-1,2-oxazol-5-yl)-1,3-thiazol-2-amine is sourced from PubChem (CID 14814701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).