4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one

C11H14N2O2 — CID 10822156

IUPAC4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one
SMILESCNCCOc1cccc2c1CC(=O)N2
InChIInChI=1S/C11H14N2O2/c1-12-5-6-15-10-4-2-3-9-8(10)7-11(14)13-9/h2-4,12H,5-7H2,1H3,(H,13,14)
InChIKeySTMJSLDMROVPBX-UHFFFAOYSA-N
MW206.24 g/mol
LogP0.78
Rot. Bonds4

About 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one

4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one (PubChem CID 10822156) has the molecular formula C11H14N2O2 and a molecular weight of 206.24 g/mol. Its IUPAC name is 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one
PubChem CID10822156
Molecular FormulaC11H14N2O2
Molecular Weight206.24 g/mol
Exact Mass206.11
IUPAC Name4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one
SMILESCNCCOc1cccc2c1CC(=O)N2
InChIInChI=1S/C11H14N2O2/c1-12-5-6-15-10-4-2-3-9-8(10)7-11(14)13-9/h2-4,12H,5-7H2,1H3,(H,13,14)
InChIKeySTMJSLDMROVPBX-UHFFFAOYSA-N
XLogP0.78
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.24
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(2-Benzylamino-ethoxy)-1,3-dihydro-indol-2-one
CID 9903877
Aplindore
CID 158784
2-[(benzylamino)methyl]-3,4,7,9-tetrahydro-2H-pyrano[2,3-e]indol-8-one
CID 9883070
4-(2-Benzylamino-ethoxy)-7-chloro-1,3-dihydro-indol-2-one
CID 10313715
4-[2-(4-Phenyl-butylamino)-ethoxy]-1,3-dihydro-indol-2-one
CID 10520031
4-[2-(3,4-Dihydro-1H-isoquinolin-2-yl)-ethoxy]-7-fluoro-1,3-dihydro-indol-2-one
CID 10592220
7-Fluoro-4-{2-[(thiophen-2-ylmethyl)-amino]-ethoxy}-1,3-dihydro-indol-2-one
CID 10638352
4-{2-[(Biphenyl-3-ylmethyl)-amino]-ethoxy}-7-fluoro-1,3-dihydro-indol-2-one
CID 10643240
4-[2-(Benzyl-methyl-amino)-ethoxy]-1,3-dihydro-indol-2-one
CID 10661630
7-Fluoro-4-{2-[(thiophen-3-ylmethyl)-amino]-ethoxy}-1,3-dihydro-indol-2-one
CID 10662428
7-Chloro-4-[2-(4-methyl-benzylamino)-ethoxy]-1,3-dihydro-indol-2-one
CID 10711537
4-(2-Benzylamino-ethoxy)-7-fluoro-1,3-dihydro-indol-2-one
CID 10732973

Frequently Asked Questions

What is the IUPAC name of 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one?
The IUPAC name of 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one (CID 10822156) is 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one.
What is the SMILES notation for 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one?
The canonical SMILES for 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one is CNCCOc1cccc2c1CC(=O)N2.
What is the InChIKey of 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one?
The InChIKey is STMJSLDMROVPBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-12-5-6-15-10-4-2-3-9-8(10)7-11(14)13-9/h2-4,12H,5-7H2,1H3,(H,13,14).
What are the key properties of 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one?
4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one has a molecular weight of 206.24 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(methylamino)ethoxy]-1,3-dihydroindol-2-one is sourced from PubChem (CID 10822156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).