6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one

C14H21N3O2 — CID 63369857

IUPAC6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one
SMILESCCNC1C(=O)Nc2cc(OCCN(C)C)ccc21
InChIInChI=1S/C14H21N3O2/c1-4-15-13-11-6-5-10(19-8-7-17(2)3)9-12(11)16-14(13)18/h5-6,9,13,15H,4,7-8H2,1-3H3,(H,16,18)
InChIKeyCXVUAWCKXGMLQA-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.23
Rot. Bonds6

About 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one

6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one (PubChem CID 63369857) has the molecular formula C14H21N3O2 and a molecular weight of 263.34 g/mol. Its IUPAC name is 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one
PubChem CID63369857
Molecular FormulaC14H21N3O2
Molecular Weight263.34 g/mol
Exact Mass263.16
IUPAC Name6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one
SMILESCCNC1C(=O)Nc2cc(OCCN(C)C)ccc21
InChIInChI=1S/C14H21N3O2/c1-4-15-13-11-6-5-10(19-8-7-17(2)3)9-12(11)16-14(13)18/h5-6,9,13,15H,4,7-8H2,1-3H3,(H,16,18)
InChIKeyCXVUAWCKXGMLQA-UHFFFAOYSA-N
XLogP1.23
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one?
The IUPAC name of 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one (CID 63369857) is 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one is CCNC1C(=O)Nc2cc(OCCN(C)C)ccc21.
What is the InChIKey of 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one?
The InChIKey is CXVUAWCKXGMLQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O2/c1-4-15-13-11-6-5-10(19-8-7-17(2)3)9-12(11)16-14(13)18/h5-6,9,13,15H,4,7-8H2,1-3H3,(H,16,18).
What are the key properties of 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one?
6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one has a molecular weight of 263.34 g/mol, XLogP of 1.23, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(dimethylamino)ethoxy]-3-(ethylamino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 63369857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).