1-(2-ethoxyethyl)-3-piperidin-4-yl-1H-indole

HCID 9903600

Notes Reactions

Substructure search Find similar structures

Basic information

Standard SMILES: CCOCCn1cc(C2CCNCC2)c2ccccc21
InChIKey: QCFSNBWEJWOEPW-UHFFFAOYSA-N
Molecular formula: C17H24N2O
Average molar mass: 272.4 g/mol
Monoisotopic mass: 272.18886339

Names & identifiers

Preferred name: 1-(2-ethoxyethyl)-3-piperidin-4-yl-1H-indole
IUPAC: 1-(2-ethoxyethyl)-3-piperidin-4-ylindole

Names & synonyms

4-[1-(2-ethoxy-ethyl)-indol-3-yl)-piperidine4-[1-(2-ethoxy-ethyl)-indol-3-yl]-piperidineSCHEMBL4058347QCFSNBWEJWOEPW-UHFFFAOYSA-N1-(2-ethoxyethyl)-3-piperidin-4-yl-1H-indole1-(2-ethoxyethyl)-3-piperidin-4-y 1-1H-indole

Database identifiers

PubChem CID: 9903600

Properties

Computed structural properties

XLogP: 2.3
Topological polar surface area: 26.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 5
Heavy atoms: 20
Formal charge: 0
Complexity: 291

Related reactions

9 records

New reaction record

HRID 85893As productTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

HRID 227270As productuspto-grants-2009_07

HRID 227271As reactantuspto-grants-2009_07

HRID 1146460As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

HRID 1840965As productuspto-grants-2004_01

HRID 1840966As reactantuspto-grants-2004_01

HRID 1840967As reactantuspto-grants-2004_01

HRID 1840968As reactantuspto-grants-2004_01

Compound notes

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