N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine

C21H16N2O2 — CID 5329851

IUPACN-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
SMILESc1ccc(Oc2ccc(Nc3ncc(-c4ccccc4)o3)cc2)cc1
InChIInChI=1S/C21H16N2O2/c1-3-7-16(8-4-1)20-15-22-21(25-20)23-17-11-13-19(14-12-17)24-18-9-5-2-6-10-18/h1-15H,(H,22,23)
InChIKeyMKASXHWBPFPYNF-UHFFFAOYSA-N
MW328.37 g/mol
LogP5.88
Rot. Bonds5

About N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine

N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine (PubChem CID 5329851) has the molecular formula C21H16N2O2 and a molecular weight of 328.37 g/mol. Its IUPAC name is N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine.

Molecular Properties

Compound NameN-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
PubChem CID5329851
Molecular FormulaC21H16N2O2
Molecular Weight328.37 g/mol
Exact Mass328.12
IUPAC NameN-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
SMILESc1ccc(Oc2ccc(Nc3ncc(-c4ccccc4)o3)cc2)cc1
InChIInChI=1S/C21H16N2O2/c1-3-7-16(8-4-1)20-15-22-21(25-20)23-17-11-13-19(14-12-17)24-18-9-5-2-6-10-18/h1-15H,(H,22,23)
InChIKeyMKASXHWBPFPYNF-UHFFFAOYSA-N
XLogP5.88
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.37
LogP ≤ 55.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,5-Diphenyl-2-oxazolamine
CID 5329404
2-[(5-Phenyl-1,3-oxazol-2-yl)amino]benzonitrile
CID 5329843
N-(2-methoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329844
3-[(5-Phenyl-1,3-oxazol-2-yl)amino]benzonitrile
CID 5329845
3-(5-Phenyl-oxazol-2-ylamino)phenylmethanol
CID 5329847
N-(3-methylphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329849
N-(3,4-dimethoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329852
N-(3,5-dimethoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329853
5-phenyl-N-(3,4,5-trimethoxyphenyl)-1,3-oxazol-2-amine
CID 5329854
N-(3-methoxy-4-oxazol-5-yl-phenyl)-5-phenyl-oxazol-2-amine
CID 497770
N-(3-methoxy-4-oxazol-5-yl-phenyl)-5-(2-methoxyphenyl)oxazol-2-amine
CID 497774
N-(3-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine
CID 5329846

Frequently Asked Questions

What is the IUPAC name of N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine?
The IUPAC name of N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine (CID 5329851) is N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine.
What is the SMILES notation for N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine?
The canonical SMILES for N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine is c1ccc(Oc2ccc(Nc3ncc(-c4ccccc4)o3)cc2)cc1.
What is the InChIKey of N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine?
The InChIKey is MKASXHWBPFPYNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O2/c1-3-7-16(8-4-1)20-15-22-21(25-20)23-17-11-13-19(14-12-17)24-18-9-5-2-6-10-18/h1-15H,(H,22,23).
What are the key properties of N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine?
N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine has a molecular weight of 328.37 g/mol, XLogP of 5.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenoxyphenyl)-5-phenyl-1,3-oxazol-2-amine is sourced from PubChem (CID 5329851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).