morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone

C24H19F3N4O3 — CID 25131103

IUPACmorpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone
SMILESO=C(c1ccc(-n2cnc(-c3c(-c4ccccc4)noc3C(F)(F)F)c2)cc1)N1CCOCC1
InChIInChI=1S/C24H19F3N4O3/c25-24(26,27)22-20(21(29-34-22)16-4-2-1-3-5-16)19-14-31(15-28-19)18-8-6-17(7-9-18)23(32)30-10-12-33-13-11-30/h1-9,14-15H,10-13H2
InChIKeyOUPKNMDFKAFUJJ-UHFFFAOYSA-N
MW468.44 g/mol
LogP4.69
Rot. Bonds4

About morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone

morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone (PubChem CID 25131103) has the molecular formula C24H19F3N4O3 and a molecular weight of 468.44 g/mol. Its IUPAC name is morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone.

Molecular Properties

Compound Namemorpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone
PubChem CID25131103
Molecular FormulaC24H19F3N4O3
Molecular Weight468.44 g/mol
Exact Mass468.14
IUPAC Namemorpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone
SMILESO=C(c1ccc(-n2cnc(-c3c(-c4ccccc4)noc3C(F)(F)F)c2)cc1)N1CCOCC1
InChIInChI=1S/C24H19F3N4O3/c25-24(26,27)22-20(21(29-34-22)16-4-2-1-3-5-16)19-14-31(15-28-19)18-8-6-17(7-9-18)23(32)30-10-12-33-13-11-30/h1-9,14-15H,10-13H2
InChIKeyOUPKNMDFKAFUJJ-UHFFFAOYSA-N
XLogP4.69
TPSA73.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500468.44
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone?
The IUPAC name of morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone (CID 25131103) is morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone.
What is the SMILES notation for morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone?
The canonical SMILES for morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone is O=C(c1ccc(-n2cnc(-c3c(-c4ccccc4)noc3C(F)(F)F)c2)cc1)N1CCOCC1.
What is the InChIKey of morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone?
The InChIKey is OUPKNMDFKAFUJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19F3N4O3/c25-24(26,27)22-20(21(29-34-22)16-4-2-1-3-5-16)19-14-31(15-28-19)18-8-6-17(7-9-18)23(32)30-10-12-33-13-11-30/h1-9,14-15H,10-13H2.
What are the key properties of morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone?
morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone has a molecular weight of 468.44 g/mol, XLogP of 4.69, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl-[4-[4-[3-phenyl-5-(trifluoromethyl)-1,2-oxazol-4-yl]imidazol-1-yl]phenyl]methanone is sourced from PubChem (CID 25131103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).