5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide

C14H12N2O3S — CID 2925864

IUPAC5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide
SMILESO=C1CC(C(=O)Nc2nccs2)C(c2ccccc2)O1
InChIInChI=1S/C14H12N2O3S/c17-11-8-10(13(18)16-14-15-6-7-20-14)12(19-11)9-4-2-1-3-5-9/h1-7,10,12H,8H2,(H,15,16,18)
InChIKeyXRTWRHWHXUZDSS-UHFFFAOYSA-N
MW288.33 g/mol
LogP2.39
Rot. Bonds3

About 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide

5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide (PubChem CID 2925864) has the molecular formula C14H12N2O3S and a molecular weight of 288.33 g/mol. Its IUPAC name is 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide
PubChem CID2925864
Molecular FormulaC14H12N2O3S
Molecular Weight288.33 g/mol
Exact Mass288.06
IUPAC Name5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide
SMILESO=C1CC(C(=O)Nc2nccs2)C(c2ccccc2)O1
InChIInChI=1S/C14H12N2O3S/c17-11-8-10(13(18)16-14-15-6-7-20-14)12(19-11)9-4-2-1-3-5-9/h1-7,10,12H,8H2,(H,15,16,18)
InChIKeyXRTWRHWHXUZDSS-UHFFFAOYSA-N
XLogP2.39
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide?
The IUPAC name of 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide (CID 2925864) is 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide.
What is the SMILES notation for 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide?
The canonical SMILES for 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide is O=C1CC(C(=O)Nc2nccs2)C(c2ccccc2)O1.
What is the InChIKey of 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide?
The InChIKey is XRTWRHWHXUZDSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O3S/c17-11-8-10(13(18)16-14-15-6-7-20-14)12(19-11)9-4-2-1-3-5-9/h1-7,10,12H,8H2,(H,15,16,18).
What are the key properties of 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide?
5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide has a molecular weight of 288.33 g/mol, XLogP of 2.39, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-oxo-2-phenyl-N-(1,3-thiazol-2-yl)oxolane-3-carboxamide is sourced from PubChem (CID 2925864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).