N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide

C20H18FN3O4 — CID 16878910

IUPACN-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)Cc1cc(-c2ccc(F)cc2)on1
InChIInChI=1S/C20H18FN3O4/c1-12(25)22-15-7-8-18(27-2)17(9-15)23-20(26)11-16-10-19(28-24-16)13-3-5-14(21)6-4-13/h3-10H,11H2,1-2H3,(H,22,25)(H,23,26)
InChIKeyFLFGUQAKPOMMIQ-UHFFFAOYSA-N
MW383.38 g/mol
LogP3.63
Rot. Bonds6

About N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide

N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide (PubChem CID 16878910) has the molecular formula C20H18FN3O4 and a molecular weight of 383.38 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide
PubChem CID16878910
Molecular FormulaC20H18FN3O4
Molecular Weight383.38 g/mol
Exact Mass383.13
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)Cc1cc(-c2ccc(F)cc2)on1
InChIInChI=1S/C20H18FN3O4/c1-12(25)22-15-7-8-18(27-2)17(9-15)23-20(26)11-16-10-19(28-24-16)13-3-5-14(21)6-4-13/h3-10H,11H2,1-2H3,(H,22,25)(H,23,26)
InChIKeyFLFGUQAKPOMMIQ-UHFFFAOYSA-N
XLogP3.63
TPSA93.46 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.38
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-methyl-3-phenyl-N-(2-propoxyphenyl)-1,2-oxazole-4-carboxamide
CID 2197808
N-(2,5-dimethoxyphenyl)-4-[5-(4-ethoxyphenyl)-1,2-oxazol-3-yl]butanamide
CID 3243514
2-(5-Dodecyl-isoxazol-3-yl)-2-phenyl-N-(2,4,6-trimethoxy-phenyl)-acetamide
CID 9984681
2-(3-Dodecyl-isoxazol-5-yl)-2-phenyl-N-(2,4,6-trimethoxy-phenyl)-acetamide
CID 10075862
N-(5-tert-butyl-2-methoxyphenyl)-3-(3,5-dimethyl-1,2-oxazol-4-yl)propanamide
CID 8494441
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[2-propoxy-5-(trifluoromethyl)phenyl]propanamide
CID 9115040
N-(4-ethoxyphenyl)-4-[5-(4-ethoxyphenyl)isoxazol-3-yl]butanamide
CID 9551508
1-(5-dodecyl-1,2-oxazol-3-yl)-N-(2,4,6-trimethoxyphenyl)cyclopentane-1-carboxamide
CID 10577749
2-(5-Dodecyl-isoxazol-3-yl)-N-(2,4,6-trimethoxy-phenyl)-isobutyramide
CID 10743615
N-(2,5-dimethoxyphenyl)-2-{[5-(4-fluorophenyl)isoxazol-3-yl]methoxy}acetamide
CID 16020707
N-phenyl-2-(5-phenylisoxazol-3-yl)acetamide
CID 16878309
N-(2-methylphenyl)-2-(5-phenyl-1,2-oxazol-3-yl)acetamide
CID 16878310

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide (CID 16878910) is N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide is COc1ccc(NC(C)=O)cc1NC(=O)Cc1cc(-c2ccc(F)cc2)on1.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide?
The InChIKey is FLFGUQAKPOMMIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O4/c1-12(25)22-15-7-8-18(27-2)17(9-15)23-20(26)11-16-10-19(28-24-16)13-3-5-14(21)6-4-13/h3-10H,11H2,1-2H3,(H,22,25)(H,23,26).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide?
N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide has a molecular weight of 383.38 g/mol, XLogP of 3.63, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-[5-(4-fluorophenyl)-1,2-oxazol-3-yl]acetamide is sourced from PubChem (CID 16878910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).