5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine

C10H10N2OS — CID 16771109

IUPAC5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine
SMILESCc1onc(/C=C/c2cccs2)c1N
InChIInChI=1S/C10H10N2OS/c1-7-10(11)9(12-13-7)5-4-8-3-2-6-14-8/h2-6H,11H2,1H3/b5-4+
InChIKeyMFGMNQGJOOCCHU-SNAWJCMRSA-N
MW206.27 g/mol
LogP2.80
Rot. Bonds2

About 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine

5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine (PubChem CID 16771109) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine.

Molecular Properties

Compound Name5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine
PubChem CID16771109
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC Name5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine
SMILESCc1onc(/C=C/c2cccs2)c1N
InChIInChI=1S/C10H10N2OS/c1-7-10(11)9(12-13-7)5-4-8-3-2-6-14-8/h2-6H,11H2,1H3/b5-4+
InChIKeyMFGMNQGJOOCCHU-SNAWJCMRSA-N
XLogP2.80
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine?
The IUPAC name of 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine (CID 16771109) is 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine.
What is the SMILES notation for 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine?
The canonical SMILES for 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine is Cc1onc(/C=C/c2cccs2)c1N.
What is the InChIKey of 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine?
The InChIKey is MFGMNQGJOOCCHU-SNAWJCMRSA-N. The full InChI is InChI=1S/C10H10N2OS/c1-7-10(11)9(12-13-7)5-4-8-3-2-6-14-8/h2-6H,11H2,1H3/b5-4+.
What are the key properties of 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine?
5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine has a molecular weight of 206.27 g/mol, XLogP of 2.80, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-[(E)-2-thiophen-2-ylethenyl]-1,2-oxazol-4-amine is sourced from PubChem (CID 16771109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).