2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide

C15H19ClN2O3S — CID 42814932

IUPAC2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)N1C(=O)CSC1c1ccccc1Cl
InChIInChI=1S/C15H19ClN2O3S/c1-10(14(20)17-7-8-21-2)18-13(19)9-22-15(18)11-5-3-4-6-12(11)16/h3-6,10,15H,7-9H2,1-2H3,(H,17,20)
InChIKeyAGGOJJJZUXHLLN-UHFFFAOYSA-N
MW342.85 g/mol
LogP2.07
Rot. Bonds6

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

2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide (PubChem CID 42814932) has the molecular formula C15H19ClN2O3S and a molecular weight of 342.85 g/mol. Its IUPAC name is 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide
PubChem CID42814932
Molecular FormulaC15H19ClN2O3S
Molecular Weight342.85 g/mol
Exact Mass342.08
IUPAC Name2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide
SMILESCOCCNC(=O)C(C)N1C(=O)CSC1c1ccccc1Cl
InChIInChI=1S/C15H19ClN2O3S/c1-10(14(20)17-7-8-21-2)18-13(19)9-22-15(18)11-5-3-4-6-12(11)16/h3-6,10,15H,7-9H2,1-2H3,(H,17,20)
InChIKeyAGGOJJJZUXHLLN-UHFFFAOYSA-N
XLogP2.07
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.85
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2-methoxyethyl)-2-[4-oxo-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidin-3-yl]propanamide
CID 42814953
methyl 2-acetamido-6-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]hexanoate
CID 3594517
N-ethyl-2-[2-(3-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide
CID 42815580
2-naphthalen-1-yl-3-propan-2-yl-1,3-thiazolidin-4-one
CID 101199621
N-[(4-fluorophenyl)methyl]-2-[2-(4-methoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]propanamide
CID 42816187
N-(2-methoxyethyl)-4-[4-oxo-3-(2-phenylethyl)-1,3-thiazolidin-2-yl]benzamide
CID 3149481
2-[2-(3,4-dimethoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)propanamide
CID 42814961
(2R)-2-[(1R)-1-(1H-indol-3-yl)-3-oxo-1H-isoindol-2-yl]-N-(2-methoxyethyl)propanamide
CID 41168499
N-[2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]ethyl]-N-propan-2-ylcyclobutanecarboxamide
CID 46137577
N-[(2-chlorophenyl)methyl]-2-[4-[2-(2-methoxyethylamino)-2-oxoethyl]piperazin-1-yl]propanamide
CID 24507244
2-(2-chlorophenyl)sulfonyl-N-(2-methoxyethyl)propanamide
CID 47217645
(2S,4S)-4-amino-1-[(2-chlorophenyl)methyl]-N-(2-methoxyethyl)pyrrolidine-2-carboxamide
CID 118759681

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide?
The IUPAC name of 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide (CID 42814932) is 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide?
The canonical SMILES for 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide is COCCNC(=O)C(C)N1C(=O)CSC1c1ccccc1Cl.
What is the InChIKey of 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide?
The InChIKey is AGGOJJJZUXHLLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19ClN2O3S/c1-10(14(20)17-7-8-21-2)18-13(19)9-22-15(18)11-5-3-4-6-12(11)16/h3-6,10,15H,7-9H2,1-2H3,(H,17,20).
What are the key properties of 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide?
2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide has a molecular weight of 342.85 g/mol, XLogP of 2.07, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-chlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 42814932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).