7-(2-aminoethyl)-1,3-dihydroindol-2-one

C10H12N2O — CID 82410863

IUPAC7-(2-aminoethyl)-1,3-dihydroindol-2-one
SMILESNCCc1cccc2c1NC(=O)C2
InChIInChI=1S/C10H12N2O/c11-5-4-7-2-1-3-8-6-9(13)12-10(7)8/h1-3H,4-6,11H2,(H,12,13)
InChIKeyJGFPGILWOZSIEV-UHFFFAOYSA-N
MW176.22 g/mol
LogP0.68
Rot. Bonds2

About 7-(2-aminoethyl)-1,3-dihydroindol-2-one

7-(2-aminoethyl)-1,3-dihydroindol-2-one (PubChem CID 82410863) has the molecular formula C10H12N2O and a molecular weight of 176.22 g/mol. Its IUPAC name is 7-(2-aminoethyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-(2-aminoethyl)-1,3-dihydroindol-2-one
PubChem CID82410863
Molecular FormulaC10H12N2O
Molecular Weight176.22 g/mol
Exact Mass176.09
IUPAC Name7-(2-aminoethyl)-1,3-dihydroindol-2-one
SMILESNCCc1cccc2c1NC(=O)C2
InChIInChI=1S/C10H12N2O/c11-5-4-7-2-1-3-8-6-9(13)12-10(7)8/h1-3H,4-6,11H2,(H,12,13)
InChIKeyJGFPGILWOZSIEV-UHFFFAOYSA-N
XLogP0.68
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one
CID 82190531
7-(4-amino-1,2-dihydroxybutyl)-1,3-dihydroindol-2-one
CID 171881489
5-(2-aminoethyl)-6-chloro-7-methyl-1,3-dihydroindol-2-one
CID 82190727
7-(4-aminobutyl)-5-chloro-1,3-dihydroindol-2-one
CID 82190651
7-(2-hydroxypropan-2-yl)-1,3-dihydroindol-2-one
CID 117282362
2-oxo-2-(2-oxo-1,3-dihydroindol-7-yl)acetic acid
CID 117293086
7-(aminomethyl)-5-bromo-1,3-dihydroindol-2-one
CID 82190668
8-(aminomethyl)-3,4-dihydro-1H-quinazolin-2-one
CID 143550005
7-(aminomethyl)-5-fluoro-1,3-dihydroindol-2-one
CID 82190628
8-(isocyanatomethyl)-3,4-dihydro-1H-quinolin-2-one
CID 117290751
8-(2-piperazin-1-ylethyl)-3,4-dihydro-1H-quinolin-2-one
CID 117402589
7-(4-amino-2-chlorophenoxy)-1,3-dihydroindol-2-one
CID 68660767

Frequently Asked Questions

What is the IUPAC name of 7-(2-aminoethyl)-1,3-dihydroindol-2-one?
The IUPAC name of 7-(2-aminoethyl)-1,3-dihydroindol-2-one (CID 82410863) is 7-(2-aminoethyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-(2-aminoethyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 7-(2-aminoethyl)-1,3-dihydroindol-2-one is NCCc1cccc2c1NC(=O)C2.
What is the InChIKey of 7-(2-aminoethyl)-1,3-dihydroindol-2-one?
The InChIKey is JGFPGILWOZSIEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O/c11-5-4-7-2-1-3-8-6-9(13)12-10(7)8/h1-3H,4-6,11H2,(H,12,13).
What are the key properties of 7-(2-aminoethyl)-1,3-dihydroindol-2-one?
7-(2-aminoethyl)-1,3-dihydroindol-2-one has a molecular weight of 176.22 g/mol, XLogP of 0.68, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-aminoethyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 82410863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).