3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one

C16H16N2O3 — CID 63370491

IUPAC3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one
SMILESCCOc1ccccc1Oc1ccc2c(c1)NC(=O)C2N
InChIInChI=1S/C16H16N2O3/c1-2-20-13-5-3-4-6-14(13)21-10-7-8-11-12(9-10)18-16(19)15(11)17/h3-9,15H,2,17H2,1H3,(H,18,19)
InChIKeyJMNKGOKOUKHYBN-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.83
Rot. Bonds4

About 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one

3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one (PubChem CID 63370491) has the molecular formula C16H16N2O3 and a molecular weight of 284.32 g/mol. Its IUPAC name is 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one
PubChem CID63370491
Molecular FormulaC16H16N2O3
Molecular Weight284.32 g/mol
Exact Mass284.12
IUPAC Name3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one
SMILESCCOc1ccccc1Oc1ccc2c(c1)NC(=O)C2N
InChIInChI=1S/C16H16N2O3/c1-2-20-13-5-3-4-6-14(13)21-10-7-8-11-12(9-10)18-16(19)15(11)17/h3-9,15H,2,17H2,1H3,(H,18,19)
InChIKeyJMNKGOKOUKHYBN-UHFFFAOYSA-N
XLogP2.83
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one?
The IUPAC name of 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one (CID 63370491) is 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one.
What is the SMILES notation for 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one?
The canonical SMILES for 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one is CCOc1ccccc1Oc1ccc2c(c1)NC(=O)C2N.
What is the InChIKey of 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one?
The InChIKey is JMNKGOKOUKHYBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O3/c1-2-20-13-5-3-4-6-14(13)21-10-7-8-11-12(9-10)18-16(19)15(11)17/h3-9,15H,2,17H2,1H3,(H,18,19).
What are the key properties of 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one?
3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one has a molecular weight of 284.32 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(2-ethoxyphenoxy)-1,3-dihydroindol-2-one is sourced from PubChem (CID 63370491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).