N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide

C18H20FNOS — CID 123212321

IUPACN-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide
SMILESCCSc1ccc(CC(=O)Nc2ccc(CC)c(F)c2)cc1
InChIInChI=1S/C18H20FNOS/c1-3-14-7-8-15(12-17(14)19)20-18(21)11-13-5-9-16(10-6-13)22-4-2/h5-10,12H,3-4,11H2,1-2H3,(H,20,21)
InChIKeyYEVYTVBRPDDTKA-UHFFFAOYSA-N
MW317.43 g/mol
LogP4.68
Rot. Bonds6

About N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide

N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide (PubChem CID 123212321) has the molecular formula C18H20FNOS and a molecular weight of 317.43 g/mol. Its IUPAC name is N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide.

Molecular Properties

Compound NameN-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide
PubChem CID123212321
Molecular FormulaC18H20FNOS
Molecular Weight317.43 g/mol
Exact Mass317.12
IUPAC NameN-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide
SMILESCCSc1ccc(CC(=O)Nc2ccc(CC)c(F)c2)cc1
InChIInChI=1S/C18H20FNOS/c1-3-14-7-8-15(12-17(14)19)20-18(21)11-13-5-9-16(10-6-13)22-4-2/h5-10,12H,3-4,11H2,1-2H3,(H,20,21)
InChIKeyYEVYTVBRPDDTKA-UHFFFAOYSA-N
XLogP4.68
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-ethylsulfanylphenyl)-N-[3-fluoro-4-(2-methyl-1-oxopropan-2-yl)phenyl]acetamide
CID 145232045
N-[4-[2-(2,4-dichlorophenyl)propan-2-yloxy]-3-fluorophenyl]-2-(4-ethylsulfanylphenyl)acetamide
CID 145196889
N-[4-[1-(3,4-difluorophenyl)sulfanylcyclopropyl]phenyl]-2-(4-ethylsulfanylphenyl)acetamide
CID 145232101
N-[4-[2-(1,3-benzoxazol-2-yl)propan-2-yl]-3-fluorophenyl]-2-(4-ethylsulfanylphenyl)acetamide
CID 145232132
2-(4-ethylsulfanylphenyl)-N-[4-[1-(4-fluorophenyl)-2-methyl-1-oxopropan-2-yl]phenyl]acetamide
CID 145231841
N-(3-fluoro-4-hydroxyphenyl)-2-(4-hydroxyphenyl)acetamide
CID 64782942
methyl 2-[4-[[2-(4-ethylsulfanylphenyl)acetyl]amino]phenyl]-2-methylpropanoate
CID 145231777
2-(4-ethylsulfanylphenyl)-N-[4-(3-fluorophenyl)-3-phenoxyphenyl]acetamide
CID 123858744
N-[3-(3-chlorophenoxy)-4-(3,4-difluorophenyl)phenyl]-2-(4-ethylsulfanylphenyl)acetamide
CID 123750729
2-(4-ethylsulfanylphenyl)-N-[3-[2-(4-fluorophenyl)ethyl]-2-oxo-1,3-benzothiazol-6-yl]acetamide
CID 145232268
2-(4-ethylsulfanylphenyl)-N-[4-pyridin-3-yl-3-(trifluoromethyl)phenyl]acetamide
CID 144539996
N-[4-[2-(2,4-dichlorophenyl)propan-2-yloxy]phenyl]-2-(4-ethylsulfanylphenyl)acetamide
CID 123763842

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide?
The IUPAC name of N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide (CID 123212321) is N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide.
What is the SMILES notation for N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide?
The canonical SMILES for N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide is CCSc1ccc(CC(=O)Nc2ccc(CC)c(F)c2)cc1.
What is the InChIKey of N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide?
The InChIKey is YEVYTVBRPDDTKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNOS/c1-3-14-7-8-15(12-17(14)19)20-18(21)11-13-5-9-16(10-6-13)22-4-2/h5-10,12H,3-4,11H2,1-2H3,(H,20,21).
What are the key properties of N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide?
N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide has a molecular weight of 317.43 g/mol, XLogP of 4.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-3-fluorophenyl)-2-(4-ethylsulfanylphenyl)acetamide is sourced from PubChem (CID 123212321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).