3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine

C15H14N2O2S — CID 81121771

IUPAC3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
SMILESCOc1ccsc1-c1noc(N)c1-c1ccc(C)cc1
InChIInChI=1S/C15H14N2O2S/c1-9-3-5-10(6-4-9)12-13(17-19-15(12)16)14-11(18-2)7-8-20-14/h3-8H,16H2,1-2H3
InChIKeyWJVTZHYZMKAVJI-UHFFFAOYSA-N
MW286.36 g/mol
LogP3.97
Rot. Bonds3

About 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine

3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine (PubChem CID 81121771) has the molecular formula C15H14N2O2S and a molecular weight of 286.36 g/mol. Its IUPAC name is 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
PubChem CID81121771
Molecular FormulaC15H14N2O2S
Molecular Weight286.36 g/mol
Exact Mass286.08
IUPAC Name3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
SMILESCOc1ccsc1-c1noc(N)c1-c1ccc(C)cc1
InChIInChI=1S/C15H14N2O2S/c1-9-3-5-10(6-4-9)12-13(17-19-15(12)16)14-11(18-2)7-8-20-14/h3-8H,16H2,1-2H3
InChIKeyWJVTZHYZMKAVJI-UHFFFAOYSA-N
XLogP3.97
TPSA61.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-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 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine (CID 81121771) is 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine is COc1ccsc1-c1noc(N)c1-c1ccc(C)cc1.
What is the InChIKey of 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine?
The InChIKey is WJVTZHYZMKAVJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O2S/c1-9-3-5-10(6-4-9)12-13(17-19-15(12)16)14-11(18-2)7-8-20-14/h3-8H,16H2,1-2H3.
What are the key properties of 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine?
3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine has a molecular weight of 286.36 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxythiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 81121771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).