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

C14H11FN2OS — CID 62514839

IUPAC3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
SMILESCc1ccc(F)c(-c2noc(N)c2-c2cccs2)c1
InChIInChI=1S/C14H11FN2OS/c1-8-4-5-10(15)9(7-8)13-12(14(16)18-17-13)11-3-2-6-19-11/h2-7H,16H2,1H3
InChIKeyHGLYMPIQICUWIH-UHFFFAOYSA-N
MW274.32 g/mol
LogP4.10
Rot. Bonds2

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

3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine (PubChem CID 62514839) has the molecular formula C14H11FN2OS and a molecular weight of 274.32 g/mol. Its IUPAC name is 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
PubChem CID62514839
Molecular FormulaC14H11FN2OS
Molecular Weight274.32 g/mol
Exact Mass274.06
IUPAC Name3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
SMILESCc1ccc(F)c(-c2noc(N)c2-c2cccs2)c1
InChIInChI=1S/C14H11FN2OS/c1-8-4-5-10(15)9(7-8)13-12(14(16)18-17-13)11-3-2-6-19-11/h2-7H,16H2,1H3
InChIKeyHGLYMPIQICUWIH-UHFFFAOYSA-N
XLogP4.10
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-fluoro-5-methylphenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine
CID 62514498
3-(5-chloro-2-methoxyphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 62500702
3-(3-chloro-2-fluorophenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 81265627
3-(3-bromo-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 104853233
5-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1H-pyrazol-3-amine
CID 62516545
4-thiophen-2-yl-3-[2-(trifluoromethyl)phenyl]-1,2-oxazol-5-amine
CID 62502729
3-(5-fluoro-3-pyridinyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 104786017
3-(5-bromo-2-chlorophenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 55078987
3-pyridin-4-yl-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 62500884
3-(2-bromo-5-methoxyphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 62501563
3-(3,5-dibromophenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 107972780
3-(3-methoxyphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine
CID 55079639

Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine?
The IUPAC name of 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine (CID 62514839) is 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine?
The canonical SMILES for 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine is Cc1ccc(F)c(-c2noc(N)c2-c2cccs2)c1.
What is the InChIKey of 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine?
The InChIKey is HGLYMPIQICUWIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2OS/c1-8-4-5-10(15)9(7-8)13-12(14(16)18-17-13)11-3-2-6-19-11/h2-7H,16H2,1H3.
What are the key properties of 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine?
3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine has a molecular weight of 274.32 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoro-5-methylphenyl)-4-thiophen-2-yl-1,2-oxazol-5-amine is sourced from PubChem (CID 62514839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).