5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine

C16H11F3N2O — CID 141185425

IUPAC5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
SMILESFC(F)(F)c1ccccc1Nc1ncc(-c2ccccc2)o1
InChIInChI=1S/C16H11F3N2O/c17-16(18,19)12-8-4-5-9-13(12)21-15-20-10-14(22-15)11-6-2-1-3-7-11/h1-10H,(H,20,21)
InChIKeyUKZDYZMIGNHAFM-UHFFFAOYSA-N
MW304.27 g/mol
LogP5.10
Rot. Bonds3

About 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine

5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine (PubChem CID 141185425) has the molecular formula C16H11F3N2O and a molecular weight of 304.27 g/mol. Its IUPAC name is 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
PubChem CID141185425
Molecular FormulaC16H11F3N2O
Molecular Weight304.27 g/mol
Exact Mass304.08
IUPAC Name5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine
SMILESFC(F)(F)c1ccccc1Nc1ncc(-c2ccccc2)o1
InChIInChI=1S/C16H11F3N2O/c17-16(18,19)12-8-4-5-9-13(12)21-15-20-10-14(22-15)11-6-2-1-3-7-11/h1-10H,(H,20,21)
InChIKeyUKZDYZMIGNHAFM-UHFFFAOYSA-N
XLogP5.10
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500304.27
LogP ≤ 55.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-(2-fluoroanilino)-1,3-oxazol-5-yl]benzoic acid
CID 139434520
N-tert-butyl-5-phenyl-1,3-oxazol-2-amine
CID 12707556
4-methyl-1-N-(5-phenyl-1,3-oxazol-2-yl)-3-N-(5-pyridin-4-yl-1,3-oxazol-2-yl)benzene-1,3-diamine
CID 11395732
5-(2-aminoethyl)-N-[2-(trifluoromethyl)phenyl]-1,3,4-oxadiazol-2-amine
CID 106966390
5-phenyl-2-[4-(trifluoromethyl)phenyl]-1,3-oxazole
CID 102265146
2-phenyl-N-[2-(trifluoromethyl)phenyl]quinolin-4-amine
CID 139593926
2-[2-(trifluoromethyl)anilino]-1,3-thiazole-5-carboxylic acid
CID 80570658
2,2,2-trifluoro-1-(5-phenyl-1,3-oxazol-2-yl)ethanone
CID 83389105
[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 3-[5-(4-fluorophenyl)-1,3-oxazol-2-yl]propanoate
CID 42490524
1-(2-fluorophenyl)-3-[4-methyl-3-[(5-pyridin-3-yl-1,3-oxazol-2-yl)amino]phenyl]urea;1-[4-methyl-3-[(5-pyridin-3-yl-1,3-oxazol-2-yl)amino]phenyl]-3-[4-(trifluoromethyl)phenyl]urea
CID 158834841
5-bromo-N-[2-(trifluoromethyl)phenyl]pyrimidin-4-amine
CID 66339922
N-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 164603929

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The IUPAC name of 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine (CID 141185425) is 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine.
What is the SMILES notation for 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The canonical SMILES for 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine is FC(F)(F)c1ccccc1Nc1ncc(-c2ccccc2)o1.
What is the InChIKey of 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
The InChIKey is UKZDYZMIGNHAFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F3N2O/c17-16(18,19)12-8-4-5-9-13(12)21-15-20-10-14(22-15)11-6-2-1-3-7-11/h1-10H,(H,20,21).
What are the key properties of 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine?
5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine has a molecular weight of 304.27 g/mol, XLogP of 5.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-[2-(trifluoromethyl)phenyl]-1,3-oxazol-2-amine is sourced from PubChem (CID 141185425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).