N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide

C17H18N2O3S — CID 93084342

IUPACN-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
SMILESCc1ccccc1[C@H]1SCC(=O)N1CC(=O)NCc1ccco1
InChIInChI=1S/C17H18N2O3S/c1-12-5-2-3-7-14(12)17-19(16(21)11-23-17)10-15(20)18-9-13-6-4-8-22-13/h2-8,17H,9-11H2,1H3,(H,18,20)/t17-/m1/s1
InChIKeyUATWNCVHDZGLGD-QGZVFWFLSA-N
MW330.41 g/mol
LogP2.48
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide

N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide (PubChem CID 93084342) has the molecular formula C17H18N2O3S and a molecular weight of 330.41 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
PubChem CID93084342
Molecular FormulaC17H18N2O3S
Molecular Weight330.41 g/mol
Exact Mass330.10
IUPAC NameN-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
SMILESCc1ccccc1[C@H]1SCC(=O)N1CC(=O)NCc1ccco1
InChIInChI=1S/C17H18N2O3S/c1-12-5-2-3-7-14(12)17-19(16(21)11-23-17)10-15(20)18-9-13-6-4-8-22-13/h2-8,17H,9-11H2,1H3,(H,18,20)/t17-/m1/s1
InChIKeyUATWNCVHDZGLGD-QGZVFWFLSA-N
XLogP2.48
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.41
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide
CID 42814442
2-[(2S)-2-(3,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide
CID 93143235
2-[2-(3-fluorophenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)acetamide
CID 42814845
N-[2-(dimethylamino)ethyl]-2-[2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide
CID 24711902
3-[2-(3,4-dimethoxyphenyl)-4-oxo-1,3-thiazolidin-3-yl]-N-(furan-2-ylmethyl)propanamide
CID 42814889
2-(2,5-dioxopyrrolidin-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 17034773
N-(furan-2-ylmethyl)-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 112779007
methyl 2-[(2S)-2-(furan-2-yl)-4-oxo-1,3-thiazolidin-3-yl]acetate
CID 129362185
2-(3,4-dihydroxypyrrolidin-1-yl)-N-(furan-2-ylmethyl)acetamide
CID 106672810
methyl 2-[[2-(4-oxo-2-phenyl-1,3-thiazolidin-3-yl)acetyl]amino]acetate
CID 23908643
N-ethyl-4-[(2R)-3-(furan-2-ylmethyl)-4-oxo-1,3-thiazolidin-2-yl]benzamide
CID 967750
N-(furan-2-ylmethyl)-2-[(2S)-2-(furan-2-yl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-5-yl]acetamide
CID 51409437

Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide (CID 93084342) is N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide is Cc1ccccc1[C@H]1SCC(=O)N1CC(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide?
The InChIKey is UATWNCVHDZGLGD-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H18N2O3S/c1-12-5-2-3-7-14(12)17-19(16(21)11-23-17)10-15(20)18-9-13-6-4-8-22-13/h2-8,17H,9-11H2,1H3,(H,18,20)/t17-/m1/s1.
What are the key properties of N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide?
N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide has a molecular weight of 330.41 g/mol, XLogP of 2.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-[(2R)-2-(2-methylphenyl)-4-oxo-1,3-thiazolidin-3-yl]acetamide is sourced from PubChem (CID 93084342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).