N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide

C15H19N3O3S — CID 9329152

IUPACN-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESO=C(CN1CCSC1=O)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C15H19N3O3S/c19-14(11-18-7-10-22-15(18)20)16-12-1-3-13(4-2-12)17-5-8-21-9-6-17/h1-4H,5-11H2,(H,16,19)
InChIKeySYWVLQHYXKJWFX-UHFFFAOYSA-N
MW321.40 g/mol
LogP1.63
Rot. Bonds4

About N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide

N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide (PubChem CID 9329152) has the molecular formula C15H19N3O3S and a molecular weight of 321.40 g/mol. Its IUPAC name is N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide
PubChem CID9329152
Molecular FormulaC15H19N3O3S
Molecular Weight321.40 g/mol
Exact Mass321.11
IUPAC NameN-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide
SMILESO=C(CN1CCSC1=O)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C15H19N3O3S/c19-14(11-18-7-10-22-15(18)20)16-12-1-3-13(4-2-12)17-5-8-21-9-6-17/h1-4H,5-11H2,(H,16,19)
InChIKeySYWVLQHYXKJWFX-UHFFFAOYSA-N
XLogP1.63
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.40
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'thioester', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide?
The IUPAC name of N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide (CID 9329152) is N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide.
What is the SMILES notation for N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide?
The canonical SMILES for N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide is O=C(CN1CCSC1=O)Nc1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide?
The InChIKey is SYWVLQHYXKJWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3S/c19-14(11-18-7-10-22-15(18)20)16-12-1-3-13(4-2-12)17-5-8-21-9-6-17/h1-4H,5-11H2,(H,16,19).
What are the key properties of N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide?
N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide has a molecular weight of 321.40 g/mol, XLogP of 1.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylphenyl)-2-(2-oxo-1,3-thiazolidin-3-yl)acetamide is sourced from PubChem (CID 9329152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).