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

C15H10ClFN2O — CID 66205397

IUPAC4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine
SMILESNc1noc(-c2ccc(F)cc2)c1-c1ccccc1Cl
InChIInChI=1S/C15H10ClFN2O/c16-12-4-2-1-3-11(12)13-14(20-19-15(13)18)9-5-7-10(17)8-6-9/h1-8H,(H2,18,19)
InChIKeyDIOYTIXBGXBIIB-UHFFFAOYSA-N
MW288.71 g/mol
LogP4.38
Rot. Bonds2

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

4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine (PubChem CID 66205397) has the molecular formula C15H10ClFN2O and a molecular weight of 288.71 g/mol. Its IUPAC name is 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine
PubChem CID66205397
Molecular FormulaC15H10ClFN2O
Molecular Weight288.71 g/mol
Exact Mass288.05
IUPAC Name4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine
SMILESNc1noc(-c2ccc(F)cc2)c1-c1ccccc1Cl
InChIInChI=1S/C15H10ClFN2O/c16-12-4-2-1-3-11(12)13-14(20-19-15(13)18)9-5-7-10(17)8-6-9/h1-8H,(H2,18,19)
InChIKeyDIOYTIXBGXBIIB-UHFFFAOYSA-N
XLogP4.38
TPSA52.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.71
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-chloro-2-fluorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine
CID 82793122
4-(2-chlorophenyl)-5-(4-methylphenyl)-1,2-oxazol-3-amine
CID 66204374
4-(2-chlorophenyl)-5-(4-iodophenyl)-1,2-oxazol-3-amine
CID 66205607
4-(2-chlorophenyl)-5-(2-fluorophenyl)-1,2-oxazol-3-amine
CID 66206213
4-(2-chlorophenyl)-5-(4-methoxyphenyl)-1,2-oxazol-3-amine
CID 66204576
5-(4-fluorophenyl)-4-(2-methoxyphenyl)-1,2-oxazol-3-amine
CID 66198769
4-(2-chlorophenyl)-5-(2,6-dichlorophenyl)-1,2-oxazol-3-amine
CID 66205609
5-(2-chlorophenyl)-4-(2,4-difluorophenyl)-1,2-oxazol-3-amine
CID 66202274
4-(2-chlorophenyl)-5-(3,5-dimethylphenyl)-1,2-oxazol-3-amine
CID 66207019
5-(3-bromo-5-chlorophenyl)-4-(2-chlorophenyl)-1,2-oxazol-3-amine
CID 107954780
4-(2,4-difluorophenyl)-5-phenyl-1,2-oxazol-3-amine
CID 66204007
5-(3-chloro-4-fluorophenyl)-4-(2-methylphenyl)-1,2-oxazol-3-amine
CID 82878281

Frequently Asked Questions

What is the IUPAC name of 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine?
The IUPAC name of 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine (CID 66205397) is 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine.
What is the SMILES notation for 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine?
The canonical SMILES for 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine is Nc1noc(-c2ccc(F)cc2)c1-c1ccccc1Cl.
What is the InChIKey of 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine?
The InChIKey is DIOYTIXBGXBIIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClFN2O/c16-12-4-2-1-3-11(12)13-14(20-19-15(13)18)9-5-7-10(17)8-6-9/h1-8H,(H2,18,19).
What are the key properties of 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine?
4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine has a molecular weight of 288.71 g/mol, XLogP of 4.38, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-chlorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-3-amine is sourced from PubChem (CID 66205397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).