N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

C17H21N3O3S — CID 56804641

IUPACN-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCN(C(=O)CN1CSCC1=O)C1CCN(c2ccccc2)C1=O
InChIInChI=1S/C17H21N3O3S/c1-2-19(15(21)10-18-12-24-11-16(18)22)14-8-9-20(17(14)23)13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3
InChIKeyBUNPKXHWCUSRBA-UHFFFAOYSA-N
MW347.44 g/mol
LogP1.17
Rot. Bonds5

About N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide

N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 56804641) has the molecular formula C17H21N3O3S and a molecular weight of 347.44 g/mol. Its IUPAC name is N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID56804641
Molecular FormulaC17H21N3O3S
Molecular Weight347.44 g/mol
Exact Mass347.13
IUPAC NameN-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESCCN(C(=O)CN1CSCC1=O)C1CCN(c2ccccc2)C1=O
InChIInChI=1S/C17H21N3O3S/c1-2-19(15(21)10-18-12-24-11-16(18)22)14-8-9-20(17(14)23)13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3
InChIKeyBUNPKXHWCUSRBA-UHFFFAOYSA-N
XLogP1.17
TPSA60.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.44
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide (CID 56804641) is N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is CCN(C(=O)CN1CSCC1=O)C1CCN(c2ccccc2)C1=O.
What is the InChIKey of N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is BUNPKXHWCUSRBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3O3S/c1-2-19(15(21)10-18-12-24-11-16(18)22)14-8-9-20(17(14)23)13-6-4-3-5-7-13/h3-7,14H,2,8-12H2,1H3.
What are the key properties of N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide?
N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 347.44 g/mol, XLogP of 1.17, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-oxo-1-phenylpyrrolidin-3-yl)-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 56804641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).