N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide

C18H14BrFN2O2 — CID 55900351

IUPACN-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
SMILESO=C(Cc1coc(-c2ccccc2)n1)NCc1cc(F)ccc1Br
InChIInChI=1S/C18H14BrFN2O2/c19-16-7-6-14(20)8-13(16)10-21-17(23)9-15-11-24-18(22-15)12-4-2-1-3-5-12/h1-8,11H,9-10H2,(H,21,23)
InChIKeyJDPMYHYCSPLOGU-UHFFFAOYSA-N
MW389.22 g/mol
LogP4.10
Rot. Bonds5

About N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide

N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide (PubChem CID 55900351) has the molecular formula C18H14BrFN2O2 and a molecular weight of 389.22 g/mol. Its IUPAC name is N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
PubChem CID55900351
Molecular FormulaC18H14BrFN2O2
Molecular Weight389.22 g/mol
Exact Mass388.02
IUPAC NameN-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
SMILESO=C(Cc1coc(-c2ccccc2)n1)NCc1cc(F)ccc1Br
InChIInChI=1S/C18H14BrFN2O2/c19-16-7-6-14(20)8-13(16)10-21-17(23)9-15-11-24-18(22-15)12-4-2-1-3-5-12/h1-8,11H,9-10H2,(H,21,23)
InChIKeyJDPMYHYCSPLOGU-UHFFFAOYSA-N
XLogP4.10
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.22
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-(3-fluorophenyl)ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 29292797
N-(5-fluoro-2-methylphenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34803562
N-(3,5-difluorophenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34169541
N-[2-(2-fluorophenyl)ethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 39441204
2-methyl-N-[2-[[2-(2-phenyl-1,3-oxazol-4-yl)acetyl]amino]ethyl]propanamide
CID 39436445
N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 55900087
2-bromo-N-[(2-bromo-5-fluorophenyl)methyl]acetamide
CID 63679531
N-[2-(tert-butylamino)-2-oxoethyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34201550
2-(3-fluorophenyl)-N-[2-[[N'-methyl-N-[(2-phenyl-1,3-oxazol-4-yl)methyl]carbamimidoyl]amino]ethyl]acetamide;hydroiodide
CID 111553684
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34807215
N-(7-fluoro-2,3,4,5-tetrahydro-1-benzoxepin-5-yl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 71887483
N-(4-anilinophenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 55457295

Frequently Asked Questions

What is the IUPAC name of N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide (CID 55900351) is N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide is O=C(Cc1coc(-c2ccccc2)n1)NCc1cc(F)ccc1Br.
What is the InChIKey of N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
The InChIKey is JDPMYHYCSPLOGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14BrFN2O2/c19-16-7-6-14(20)8-13(16)10-21-17(23)9-15-11-24-18(22-15)12-4-2-1-3-5-12/h1-8,11H,9-10H2,(H,21,23).
What are the key properties of N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?
N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide has a molecular weight of 389.22 g/mol, XLogP of 4.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-bromo-5-fluorophenyl)methyl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 55900351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).