3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one

C11H8N2OS — CID 151897433

IUPAC3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccccc2C1c1cncs1
InChIInChI=1S/C11H8N2OS/c14-11-10(9-5-12-6-15-9)7-3-1-2-4-8(7)13-11/h1-6,10H,(H,13,14)
InChIKeySSAPAJGGJRHUTM-UHFFFAOYSA-N
MW216.27 g/mol
LogP2.23
Rot. Bonds1

About 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one

3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one (PubChem CID 151897433) has the molecular formula C11H8N2OS and a molecular weight of 216.27 g/mol. Its IUPAC name is 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one
PubChem CID151897433
Molecular FormulaC11H8N2OS
Molecular Weight216.27 g/mol
Exact Mass216.04
IUPAC Name3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccccc2C1c1cncs1
InChIInChI=1S/C11H8N2OS/c14-11-10(9-5-12-6-15-9)7-3-1-2-4-8(7)13-11/h1-6,10H,(H,13,14)
InChIKeySSAPAJGGJRHUTM-UHFFFAOYSA-N
XLogP2.23
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.27
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one?
The IUPAC name of 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one (CID 151897433) is 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one?
The canonical SMILES for 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one is O=C1Nc2ccccc2C1c1cncs1.
What is the InChIKey of 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one?
The InChIKey is SSAPAJGGJRHUTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2OS/c14-11-10(9-5-12-6-15-9)7-3-1-2-4-8(7)13-11/h1-6,10H,(H,13,14).
What are the key properties of 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one?
3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one has a molecular weight of 216.27 g/mol, XLogP of 2.23, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,3-thiazol-5-yl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 151897433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).