7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one

C11H14N2O — CID 82190531

IUPAC7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one
SMILESCc1cc(CCN)c2c(c1)CC(=O)N2
InChIInChI=1S/C11H14N2O/c1-7-4-8(2-3-12)11-9(5-7)6-10(14)13-11/h4-5H,2-3,6,12H2,1H3,(H,13,14)
InChIKeyDEXTUXRRXIUQQF-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.99
Rot. Bonds2

About 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one

7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one (PubChem CID 82190531) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one
PubChem CID82190531
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one
SMILESCc1cc(CCN)c2c(c1)CC(=O)N2
InChIInChI=1S/C11H14N2O/c1-7-4-8(2-3-12)11-9(5-7)6-10(14)13-11/h4-5H,2-3,6,12H2,1H3,(H,13,14)
InChIKeyDEXTUXRRXIUQQF-UHFFFAOYSA-N
XLogP0.99
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-ethyl-5-methyl-1,3-dihydroindol-2-one
CID 142337583
7-(2-aminopropyl)-5-methyl-1,3-dihydroindol-2-one
CID 82190534
5-(2-aminoethyl)-6-chloro-7-methyl-1,3-dihydroindol-2-one
CID 82190727
7-[(1-hydroxycyclopropyl)methyl]-5-methyl-1,3-dihydroindol-2-one
CID 117309426
7-(2-aminoethyl)-1,3-dihydroindol-2-one
CID 82410863
7-(4-aminobutyl)-5-chloro-1,3-dihydroindol-2-one
CID 82190651
7-(aminomethyl)-5-fluoro-1,3-dihydroindol-2-one
CID 82190628
7-(aminomethyl)-5-bromo-1,3-dihydroindol-2-one
CID 82190668
2-[1-(5-methyl-2-oxo-1,3-dihydroindol-7-yl)cyclopropyl]acetic acid
CID 117364760
5-[amino-(4-methylphenyl)methyl]-7-ethyl-1,3-dihydroindol-2-one
CID 82172898
5-tert-butyl-7-ethyl-1,3-dihydroindol-2-one
CID 134457828
5-amino-7-(fluoromethyl)-1,3-dihydroindol-2-one
CID 69465620

Frequently Asked Questions

What is the IUPAC name of 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one?
The IUPAC name of 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one (CID 82190531) is 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one.
What is the SMILES notation for 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one?
The canonical SMILES for 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one is Cc1cc(CCN)c2c(c1)CC(=O)N2.
What is the InChIKey of 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one?
The InChIKey is DEXTUXRRXIUQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-7-4-8(2-3-12)11-9(5-7)6-10(14)13-11/h4-5H,2-3,6,12H2,1H3,(H,13,14).
What are the key properties of 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one?
7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one has a molecular weight of 190.25 g/mol, XLogP of 0.99, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-aminoethyl)-5-methyl-1,3-dihydroindol-2-one is sourced from PubChem (CID 82190531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).