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

C16H13FN2O — CID 43157945

IUPAC3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine
SMILESCc1ccccc1-c1c(-c2ccc(F)cc2)noc1N
InChIInChI=1S/C16H13FN2O/c1-10-4-2-3-5-13(10)14-15(19-20-16(14)18)11-6-8-12(17)9-7-11/h2-9H,18H2,1H3
InChIKeyQGWBNWSVNJKBTI-UHFFFAOYSA-N
MW268.29 g/mol
LogP4.04
Rot. Bonds2

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

3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine (PubChem CID 43157945) has the molecular formula C16H13FN2O and a molecular weight of 268.29 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine
PubChem CID43157945
Molecular FormulaC16H13FN2O
Molecular Weight268.29 g/mol
Exact Mass268.10
IUPAC Name3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine
SMILESCc1ccccc1-c1c(-c2ccc(F)cc2)noc1N
InChIInChI=1S/C16H13FN2O/c1-10-4-2-3-5-13(10)14-15(19-20-16(14)18)11-6-8-12(17)9-7-11/h2-9H,18H2,1H3
InChIKeyQGWBNWSVNJKBTI-UHFFFAOYSA-N
XLogP4.04
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(4-fluorophenyl)-3-(2-methylphenyl)-1,2-oxazol-5-amine
CID 43335890
4-(2-bromophenyl)-3-(4-fluorophenyl)-1,2-oxazol-5-amine
CID 62830346
3-(4-fluorophenyl)-4-(4-methylphenyl)-1,2-oxazol-5-amine
CID 62830483
3-(2-bromo-3-methylphenyl)-4-(4-fluorophenyl)-1,2-oxazol-5-amine
CID 107982868
4-(2-methylphenyl)-3-pyridazin-4-yl-1,2-oxazol-5-amine
CID 104670744
3-(2-fluoro-5-methylphenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine
CID 62514498
4-(3-fluorophenyl)-3-(2-methylphenyl)-1,2-oxazol-5-amine
CID 43336065
3-(3-bromo-4-chlorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine
CID 107988922
3-(4-fluorophenyl)-4-(3-methylphenyl)-1,2-oxazol-5-amine
CID 62829957
4-(2-methylphenyl)-3-(1H-pyrazol-5-yl)-1,2-oxazol-5-amine
CID 63080317
3-(2,6-dichlorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine
CID 43335610
3-(2,5-dimethylphenyl)-4-(4-fluorophenyl)-1,2-oxazol-5-amine
CID 43158169

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine?
The IUPAC name of 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine (CID 43157945) is 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine.
What is the SMILES notation for 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine?
The canonical SMILES for 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine is Cc1ccccc1-c1c(-c2ccc(F)cc2)noc1N.
What is the InChIKey of 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine?
The InChIKey is QGWBNWSVNJKBTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O/c1-10-4-2-3-5-13(10)14-15(19-20-16(14)18)11-6-8-12(17)9-7-11/h2-9H,18H2,1H3.
What are the key properties of 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine?
3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine has a molecular weight of 268.29 g/mol, XLogP of 4.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-5-amine is sourced from PubChem (CID 43157945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).