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

C18H15FN2O4S — CID 78882457

IUPACN-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide
SMILESO=C(CS(=O)(=O)Cc1coc(-c2ccccc2)n1)Nc1ccccc1F
InChIInChI=1S/C18H15FN2O4S/c19-15-8-4-5-9-16(15)21-17(22)12-26(23,24)11-14-10-25-18(20-14)13-6-2-1-3-7-13/h1-10H,11-12H2,(H,21,22)
InChIKeyNBEQZJUSRYLIHB-UHFFFAOYSA-N
MW374.39 g/mol
LogP3.03
Rot. Bonds6

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

N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide (PubChem CID 78882457) has the molecular formula C18H15FN2O4S and a molecular weight of 374.39 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide
PubChem CID78882457
Molecular FormulaC18H15FN2O4S
Molecular Weight374.39 g/mol
Exact Mass374.07
IUPAC NameN-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide
SMILESO=C(CS(=O)(=O)Cc1coc(-c2ccccc2)n1)Nc1ccccc1F
InChIInChI=1S/C18H15FN2O4S/c19-15-8-4-5-9-16(15)21-17(22)12-26(23,24)11-14-10-25-18(20-14)13-6-2-1-3-7-13/h1-10H,11-12H2,(H,21,22)
InChIKeyNBEQZJUSRYLIHB-UHFFFAOYSA-N
XLogP3.03
TPSA89.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.39
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-fluorophenyl)-2-[(2-thiophen-2-yl-1,3-thiazol-4-yl)methylsulfonyl]acetamide
CID 78852488
N-(2-acetylphenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 34805925
N-(2,3-dimethylphenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 39428151
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
2-[(1-benzylimidazol-2-yl)methylsulfonyl]-N-(2-fluorophenyl)acetamide
CID 78876781
[2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl 2-[2-(2-fluoroanilino)-2-oxoethoxy]benzoate
CID 31700030
N-(4-anilinophenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 55457295
N-[(4-fluorophenyl)methyl]-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]propanamide
CID 55746214
N-(4-iodophenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 39427929
N-(2-chloro-4-iodophenyl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
CID 55677449
2-(4-fluorophenyl)-4-[[2-(trifluoromethyl)phenyl]methylsulfonylmethyl]-1,3-oxazole
CID 86923014

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide (CID 78882457) is N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide is O=C(CS(=O)(=O)Cc1coc(-c2ccccc2)n1)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide?
The InChIKey is NBEQZJUSRYLIHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O4S/c19-15-8-4-5-9-16(15)21-17(22)12-26(23,24)11-14-10-25-18(20-14)13-6-2-1-3-7-13/h1-10H,11-12H2,(H,21,22).
What are the key properties of N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide?
N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide has a molecular weight of 374.39 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-[(2-phenyl-1,3-oxazol-4-yl)methylsulfonyl]acetamide is sourced from PubChem (CID 78882457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).