2-(2-oxo-1,3-dihydroindol-3-yl)acetate

C10H8NO3- — CID 25200337

IUPAC2-(2-oxo-1,3-dihydroindol-3-yl)acetate
SMILESO=C([O-])CC1C(=O)Nc2ccccc21
InChIInChI=1S/C10H9NO3/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13)/p-1
InChIKeyILGMGHZPXRDCCS-UHFFFAOYSA-M
MW190.18 g/mol
LogP-0.14
Rot. Bonds2

About 2-(2-oxo-1,3-dihydroindol-3-yl)acetate

2-(2-oxo-1,3-dihydroindol-3-yl)acetate (PubChem CID 25200337) has the molecular formula C10H8NO3- and a molecular weight of 190.18 g/mol. Its IUPAC name is 2-(2-oxo-1,3-dihydroindol-3-yl)acetate.

Molecular Properties

Compound Name2-(2-oxo-1,3-dihydroindol-3-yl)acetate
PubChem CID25200337
Molecular FormulaC10H8NO3-
Molecular Weight190.18 g/mol
Exact Mass190.05
IUPAC Name2-(2-oxo-1,3-dihydroindol-3-yl)acetate
SMILESO=C([O-])CC1C(=O)Nc2ccccc21
InChIInChI=1S/C10H9NO3/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13)/p-1
InChIKeyILGMGHZPXRDCCS-UHFFFAOYSA-M
XLogP-0.14
TPSA69.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.18
LogP ≤ 5-0.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-oxo-1,3-dihydroindol-3-yl)acetate?
The IUPAC name of 2-(2-oxo-1,3-dihydroindol-3-yl)acetate (CID 25200337) is 2-(2-oxo-1,3-dihydroindol-3-yl)acetate.
What is the SMILES notation for 2-(2-oxo-1,3-dihydroindol-3-yl)acetate?
The canonical SMILES for 2-(2-oxo-1,3-dihydroindol-3-yl)acetate is O=C([O-])CC1C(=O)Nc2ccccc21.
What is the InChIKey of 2-(2-oxo-1,3-dihydroindol-3-yl)acetate?
The InChIKey is ILGMGHZPXRDCCS-UHFFFAOYSA-M. The full InChI is InChI=1S/C10H9NO3/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13)/p-1.
What are the key properties of 2-(2-oxo-1,3-dihydroindol-3-yl)acetate?
2-(2-oxo-1,3-dihydroindol-3-yl)acetate has a molecular weight of 190.18 g/mol, XLogP of -0.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxo-1,3-dihydroindol-3-yl)acetate is sourced from PubChem (CID 25200337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).