4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one

C18H20N2O2 — CID 10661630

IUPAC4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one
SMILESCN(CCOc1cccc2c1CC(=O)N2)Cc1ccccc1
InChIInChI=1S/C18H20N2O2/c1-20(13-14-6-3-2-4-7-14)10-11-22-17-9-5-8-16-15(17)12-18(21)19-16/h2-9H,10-13H2,1H3,(H,19,21)
InChIKeyZCTQZPVZSXAFAK-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.69
Rot. Bonds6

About 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one

4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one (PubChem CID 10661630) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one
PubChem CID10661630
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one
SMILESCN(CCOc1cccc2c1CC(=O)N2)Cc1ccccc1
InChIInChI=1S/C18H20N2O2/c1-20(13-14-6-3-2-4-7-14)10-11-22-17-9-5-8-16-15(17)12-18(21)19-16/h2-9H,10-13H2,1H3,(H,19,21)
InChIKeyZCTQZPVZSXAFAK-UHFFFAOYSA-N
XLogP2.69
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one?
The IUPAC name of 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one (CID 10661630) is 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one.
What is the SMILES notation for 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one?
The canonical SMILES for 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one is CN(CCOc1cccc2c1CC(=O)N2)Cc1ccccc1.
What is the InChIKey of 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one?
The InChIKey is ZCTQZPVZSXAFAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-20(13-14-6-3-2-4-7-14)10-11-22-17-9-5-8-16-15(17)12-18(21)19-16/h2-9H,10-13H2,1H3,(H,19,21).
What are the key properties of 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one?
4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one has a molecular weight of 296.37 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[benzyl(methyl)amino]ethoxy]-1,3-dihydroindol-2-one is sourced from PubChem (CID 10661630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).