N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide

C16H14F2N2O2S2 — CID 75526110

IUPACN-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide
SMILESO=C1CSCN1CC(=O)N(Cc1cccs1)c1ccc(F)cc1F
InChIInChI=1S/C16H14F2N2O2S2/c17-11-3-4-14(13(18)6-11)20(7-12-2-1-5-24-12)15(21)8-19-10-23-9-16(19)22/h1-6H,7-10H2
InChIKeyGVOLMQQVEPGLCK-UHFFFAOYSA-N
MW368.43 g/mol
LogP3.09
Rot. Bonds5

About N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide

N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 75526110) has the molecular formula C16H14F2N2O2S2 and a molecular weight of 368.43 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide
PubChem CID75526110
Molecular FormulaC16H14F2N2O2S2
Molecular Weight368.43 g/mol
Exact Mass368.05
IUPAC NameN-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide
SMILESO=C1CSCN1CC(=O)N(Cc1cccs1)c1ccc(F)cc1F
InChIInChI=1S/C16H14F2N2O2S2/c17-11-3-4-14(13(18)6-11)20(7-12-2-1-5-24-12)15(21)8-19-10-23-9-16(19)22/h1-6H,7-10H2
InChIKeyGVOLMQQVEPGLCK-UHFFFAOYSA-N
XLogP3.09
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.43
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide (CID 75526110) is N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide is O=C1CSCN1CC(=O)N(Cc1cccs1)c1ccc(F)cc1F.
What is the InChIKey of N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is GVOLMQQVEPGLCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14F2N2O2S2/c17-11-3-4-14(13(18)6-11)20(7-12-2-1-5-24-12)15(21)8-19-10-23-9-16(19)22/h1-6H,7-10H2.
What are the key properties of N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide?
N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 368.43 g/mol, XLogP of 3.09, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-2-(4-oxo-1,3-thiazolidin-3-yl)-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 75526110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).