1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone

C11H13NOS — CID 14941162

IUPAC1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone
SMILESO=C(CN1CCSC1)c1ccccc1
InChIInChI=1S/C11H13NOS/c13-11(8-12-6-7-14-9-12)10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKeyUKMLVWZUWWISKP-UHFFFAOYSA-N
MW207.30 g/mol
LogP1.88
Rot. Bonds3

About 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone

1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone (PubChem CID 14941162) has the molecular formula C11H13NOS and a molecular weight of 207.30 g/mol. Its IUPAC name is 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone.

Molecular Properties

Compound Name1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone
PubChem CID14941162
Molecular FormulaC11H13NOS
Molecular Weight207.30 g/mol
Exact Mass207.07
IUPAC Name1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone
SMILESO=C(CN1CCSC1)c1ccccc1
InChIInChI=1S/C11H13NOS/c13-11(8-12-6-7-14-9-12)10-4-2-1-3-5-10/h1-5H,6-9H2
InChIKeyUKMLVWZUWWISKP-UHFFFAOYSA-N
XLogP1.88
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.30
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone?
The IUPAC name of 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone (CID 14941162) is 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone.
What is the SMILES notation for 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone?
The canonical SMILES for 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone is O=C(CN1CCSC1)c1ccccc1.
What is the InChIKey of 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone?
The InChIKey is UKMLVWZUWWISKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NOS/c13-11(8-12-6-7-14-9-12)10-4-2-1-3-5-10/h1-5H,6-9H2.
What are the key properties of 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone?
1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone has a molecular weight of 207.30 g/mol, XLogP of 1.88, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(1,3-thiazolidin-3-yl)ethanone is sourced from PubChem (CID 14941162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).