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

C19H20N2O2S — CID 42806131

IUPACN-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide
SMILESCCc1ccccc1N1C(=O)CSC1c1cccc(NC(C)=O)c1
InChIInChI=1S/C19H20N2O2S/c1-3-14-7-4-5-10-17(14)21-18(23)12-24-19(21)15-8-6-9-16(11-15)20-13(2)22/h4-11,19H,3,12H2,1-2H3,(H,20,22)
InChIKeyFKNRWQKCLZEFJU-UHFFFAOYSA-N
MW340.45 g/mol
LogP3.99
Rot. Bonds4

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

N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide (PubChem CID 42806131) has the molecular formula C19H20N2O2S and a molecular weight of 340.45 g/mol. Its IUPAC name is N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide
PubChem CID42806131
Molecular FormulaC19H20N2O2S
Molecular Weight340.45 g/mol
Exact Mass340.12
IUPAC NameN-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide
SMILESCCc1ccccc1N1C(=O)CSC1c1cccc(NC(C)=O)c1
InChIInChI=1S/C19H20N2O2S/c1-3-14-7-4-5-10-17(14)21-18(23)12-24-19(21)15-8-6-9-16(11-15)20-13(2)22/h4-11,19H,3,12H2,1-2H3,(H,20,22)
InChIKeyFKNRWQKCLZEFJU-UHFFFAOYSA-N
XLogP3.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide?
The IUPAC name of N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide (CID 42806131) is N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide.
What is the SMILES notation for N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide?
The canonical SMILES for N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide is CCc1ccccc1N1C(=O)CSC1c1cccc(NC(C)=O)c1.
What is the InChIKey of N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide?
The InChIKey is FKNRWQKCLZEFJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2S/c1-3-14-7-4-5-10-17(14)21-18(23)12-24-19(21)15-8-6-9-16(11-15)20-13(2)22/h4-11,19H,3,12H2,1-2H3,(H,20,22).
What are the key properties of N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide?
N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide has a molecular weight of 340.45 g/mol, XLogP of 3.99, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]acetamide is sourced from PubChem (CID 42806131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).