N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide

C19H20N2O3S — CID 42807105

IUPACN-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C2SCC(=O)N2c2ccccc2OC)cc1
InChIInChI=1S/C19H20N2O3S/c1-3-17(22)20-14-10-8-13(9-11-14)19-21(18(23)12-25-19)15-6-4-5-7-16(15)24-2/h4-11,19H,3,12H2,1-2H3,(H,20,22)
InChIKeyLSHYQXRGIUURIJ-UHFFFAOYSA-N
MW356.45 g/mol
LogP3.82
Rot. Bonds5

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

N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide (PubChem CID 42807105) has the molecular formula C19H20N2O3S and a molecular weight of 356.45 g/mol. Its IUPAC name is N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide.

Molecular Properties

Compound NameN-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide
PubChem CID42807105
Molecular FormulaC19H20N2O3S
Molecular Weight356.45 g/mol
Exact Mass356.12
IUPAC NameN-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide
SMILESCCC(=O)Nc1ccc(C2SCC(=O)N2c2ccccc2OC)cc1
InChIInChI=1S/C19H20N2O3S/c1-3-17(22)20-14-10-8-13(9-11-14)19-21(18(23)12-25-19)15-6-4-5-7-16(15)24-2/h4-11,19H,3,12H2,1-2H3,(H,20,22)
InChIKeyLSHYQXRGIUURIJ-UHFFFAOYSA-N
XLogP3.82
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl 4-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]anilino]-4-oxobutanoate
CID 42807132
4-fluoro-N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]benzamide
CID 42807109
N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]cyclohexanecarboxamide
CID 42807114
4-tert-butyl-N-[4-[(2S)-3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]benzamide
CID 93126876
N-[4-(4-oxo-3-phenyl-1,3-thiazolidin-2-yl)phenyl]propanamide
CID 42804052
N-[4-[3-(2-ethylphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-2-phenylacetamide
CID 46132819
(3R)-N-[4-[(2S)-3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-3,5,5-trimethylhexanamide
CID 93126239
N-[4-[(2S)-3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-2-fluorobenzamide
CID 93126247
N-[4-[(2S)-3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]naphthalene-1-carboxamide
CID 93126259
N-[4-[(2S)-3-(2-ethoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]-3-fluorobenzamide
CID 93126255
4-methoxy-N-[4-[(2R)-4-oxo-3-(2-propylphenyl)-1,3-thiazolidin-2-yl]phenyl]benzamide
CID 93005218
N-[4-[3-(3-fluorophenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide
CID 24715605

Frequently Asked Questions

What is the IUPAC name of N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide?
The IUPAC name of N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide (CID 42807105) is N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide.
What is the SMILES notation for N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide?
The canonical SMILES for N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide is CCC(=O)Nc1ccc(C2SCC(=O)N2c2ccccc2OC)cc1.
What is the InChIKey of N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide?
The InChIKey is LSHYQXRGIUURIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O3S/c1-3-17(22)20-14-10-8-13(9-11-14)19-21(18(23)12-25-19)15-6-4-5-7-16(15)24-2/h4-11,19H,3,12H2,1-2H3,(H,20,22).
What are the key properties of N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide?
N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide has a molecular weight of 356.45 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[3-(2-methoxyphenyl)-4-oxo-1,3-thiazolidin-2-yl]phenyl]propanamide is sourced from PubChem (CID 42807105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).