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

C16H16N2OS — CID 66198467

IUPAC5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
SMILESCCc1ccc(-c2onc(N)c2-c2ccc(C)cc2)s1
InChIInChI=1S/C16H16N2OS/c1-3-12-8-9-13(20-12)15-14(16(17)18-19-15)11-6-4-10(2)5-7-11/h4-9H,3H2,1-2H3,(H2,17,18)
InChIKeyFQZQNQCENZGMKH-UHFFFAOYSA-N
MW284.38 g/mol
LogP4.52
Rot. Bonds3

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

5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine (PubChem CID 66198467) has the molecular formula C16H16N2OS and a molecular weight of 284.38 g/mol. Its IUPAC name is 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
PubChem CID66198467
Molecular FormulaC16H16N2OS
Molecular Weight284.38 g/mol
Exact Mass284.10
IUPAC Name5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
SMILESCCc1ccc(-c2onc(N)c2-c2ccc(C)cc2)s1
InChIInChI=1S/C16H16N2OS/c1-3-12-8-9-13(20-12)15-14(16(17)18-19-15)11-6-4-10(2)5-7-11/h4-9H,3H2,1-2H3,(H2,17,18)
InChIKeyFQZQNQCENZGMKH-UHFFFAOYSA-N
XLogP4.52
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.38
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine with MolForge

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

Launch Full Analysis

Related Compounds

5-(5-ethylthiophen-2-yl)-4-phenyl-1,2-oxazol-3-amine
CID 66200911
4-(3,4-dichlorophenyl)-5-(5-ethylthiophen-2-yl)-1,2-oxazol-3-amine
CID 66198818
4-(3-bromophenyl)-5-(5-ethylthiophen-2-yl)-1,2-oxazol-3-amine
CID 66199043
5-(4-methylphenyl)-4-phenyl-1,2-oxazol-3-amine
CID 66199506
5-(4-bromophenyl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66199070
4-(3,4-dichlorophenyl)-5-(5-methylthiophen-2-yl)-1,2-oxazol-3-amine
CID 66199218
4-(4-methylphenyl)-5-(4-methylsulfanylphenyl)-1,2-oxazol-3-amine
CID 79212754
3-(5-ethylthiophen-2-yl)-4-pyridin-4-yl-1,2-oxazol-5-amine
CID 80525019
5-(5-bromothiophen-2-yl)-4-(3,5-difluorophenyl)-1,2-oxazol-3-amine
CID 66202073
4-(4-ethoxyphenyl)-5-(2-methylfuran-3-yl)-1,2-oxazol-3-amine
CID 66199843
4-(3-methylphenyl)-5-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66197888
5-(2-chloro-6-fluorophenyl)-4-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66200268

Frequently Asked Questions

What is the IUPAC name of 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine?
The IUPAC name of 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine (CID 66198467) is 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine is CCc1ccc(-c2onc(N)c2-c2ccc(C)cc2)s1.
What is the InChIKey of 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine?
The InChIKey is FQZQNQCENZGMKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2OS/c1-3-12-8-9-13(20-12)15-14(16(17)18-19-15)11-6-4-10(2)5-7-11/h4-9H,3H2,1-2H3,(H2,17,18).
What are the key properties of 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine?
5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine has a molecular weight of 284.38 g/mol, XLogP of 4.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-ethylthiophen-2-yl)-4-(4-methylphenyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66198467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).