4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide

C23H26N2O2S — CID 93486528

IUPAC4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide
SMILESCN(C(=O)c1ccc([C@H]2SCC(=O)N2Cc2ccccc2)cc1)C1CCCC1
InChIInChI=1S/C23H26N2O2S/c1-24(20-9-5-6-10-20)22(27)18-11-13-19(14-12-18)23-25(21(26)16-28-23)15-17-7-3-2-4-8-17/h2-4,7-8,11-14,20,23H,5-6,9-10,15-16H2,1H3/t23-/m1/s1
InChIKeyBXBLWVFBJVJQDT-HSZRJFAPSA-N
MW394.54 g/mol
LogP4.48
Rot. Bonds5

About 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide

4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide (PubChem CID 93486528) has the molecular formula C23H26N2O2S and a molecular weight of 394.54 g/mol. Its IUPAC name is 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide.

Molecular Properties

Compound Name4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide
PubChem CID93486528
Molecular FormulaC23H26N2O2S
Molecular Weight394.54 g/mol
Exact Mass394.17
IUPAC Name4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide
SMILESCN(C(=O)c1ccc([C@H]2SCC(=O)N2Cc2ccccc2)cc1)C1CCCC1
InChIInChI=1S/C23H26N2O2S/c1-24(20-9-5-6-10-20)22(27)18-11-13-19(14-12-18)23-25(21(26)16-28-23)15-17-7-3-2-4-8-17/h2-4,7-8,11-14,20,23H,5-6,9-10,15-16H2,1H3/t23-/m1/s1
InChIKeyBXBLWVFBJVJQDT-HSZRJFAPSA-N
XLogP4.48
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.54
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2S)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentylbenzamide
CID 40560076
4-(3-benzyl-4-oxo-1,3-thiazolidin-2-yl)-N-(2-methylpropyl)benzamide
CID 3139076
4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-[(2R)-3-methylbutan-2-yl]benzamide
CID 100561810
(2S)-3-benzyl-2-(4-chlorophenyl)-1,3-thiazolidin-4-one
CID 674166
4-[(2S)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-[[(2R)-oxolan-2-yl]methyl]benzamide
CID 1071254
4-[(2S)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-[(4-methoxyphenyl)methyl]benzamide
CID 1278524
4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-(2-methylphenyl)benzamide
CID 1245454
4-[(2S)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-(pyridin-4-ylmethyl)benzamide
CID 1142986
4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-(pyridin-2-ylmethyl)benzamide
CID 1280635
1-[4-(3-benzyl-4-oxo-1,3-thiazolidin-2-yl)benzoyl]piperidine-4-carboxamide
CID 23939297
4-(3-benzyl-4-oxo-1,3-thiazolidin-2-yl)-N-(pyridin-2-ylmethyl)benzamide
CID 5008223
4-(3-benzyl-4-oxo-1,3-thiazolidin-2-yl)-N-[[2-(piperidin-1-ylmethyl)phenyl]methyl]benzamide
CID 133203275

Frequently Asked Questions

What is the IUPAC name of 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide?
The IUPAC name of 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide (CID 93486528) is 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide.
What is the SMILES notation for 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide?
The canonical SMILES for 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide is CN(C(=O)c1ccc([C@H]2SCC(=O)N2Cc2ccccc2)cc1)C1CCCC1.
What is the InChIKey of 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide?
The InChIKey is BXBLWVFBJVJQDT-HSZRJFAPSA-N. The full InChI is InChI=1S/C23H26N2O2S/c1-24(20-9-5-6-10-20)22(27)18-11-13-19(14-12-18)23-25(21(26)16-28-23)15-17-7-3-2-4-8-17/h2-4,7-8,11-14,20,23H,5-6,9-10,15-16H2,1H3/t23-/m1/s1.
What are the key properties of 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide?
4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide has a molecular weight of 394.54 g/mol, XLogP of 4.48, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentyl-N-methylbenzamide is sourced from PubChem (CID 93486528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).