N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide

C18H17FN2O2S — CID 24715230

IUPACN-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(C2SCC(=O)N2c2ccc(C)c(F)c2)c1
InChIInChI=1S/C18H17FN2O2S/c1-11-6-7-15(9-16(11)19)21-17(23)10-24-18(21)13-4-3-5-14(8-13)20-12(2)22/h3-9,18H,10H2,1-2H3,(H,20,22)
InChIKeyWNHPKGCADZSEAI-UHFFFAOYSA-N
MW344.41 g/mol
LogP3.87
Rot. Bonds3

About N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide

N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide (PubChem CID 24715230) has the molecular formula C18H17FN2O2S and a molecular weight of 344.41 g/mol. Its IUPAC name is N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide
PubChem CID24715230
Molecular FormulaC18H17FN2O2S
Molecular Weight344.41 g/mol
Exact Mass344.10
IUPAC NameN-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide
SMILESCC(=O)Nc1cccc(C2SCC(=O)N2c2ccc(C)c(F)c2)c1
InChIInChI=1S/C18H17FN2O2S/c1-11-6-7-15(9-16(11)19)21-17(23)10-24-18(21)13-4-3-5-14(8-13)20-12(2)22/h3-9,18H,10H2,1-2H3,(H,20,22)
InChIKeyWNHPKGCADZSEAI-UHFFFAOYSA-N
XLogP3.87
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.41
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide?
The IUPAC name of N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide (CID 24715230) is N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide is CC(=O)Nc1cccc(C2SCC(=O)N2c2ccc(C)c(F)c2)c1.
What is the InChIKey of N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide?
The InChIKey is WNHPKGCADZSEAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O2S/c1-11-6-7-15(9-16(11)19)21-17(23)10-24-18(21)13-4-3-5-14(8-13)20-12(2)22/h3-9,18H,10H2,1-2H3,(H,20,22).
What are the key properties of N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide?
N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide has a molecular weight of 344.41 g/mol, XLogP of 3.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-(3-fluoro-4-methylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide is sourced from PubChem (CID 24715230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).