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4-(4-methyl-1-piperazinyl)-1H-indole

HCID 22015351
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Basic information

Standard SMILES
CN1CCN(c2cccc3[nH]ccc23)CC1
InChIKey
LNBPBQCQMJPTQS-UHFFFAOYSA-N
Molecular formula
C13H17N3
Average molar mass
215.29 g/mol

Names & identifiers

Preferred name
4-(4-methyl-1-piperazinyl)-1H-indole
IUPAC
4-(4-methylpiperazin-1-yl)-1H-indole

Names & synonyms

4-(4-methylpiperazin-1-yl)-1H-indole412048-48-74-(4-methyl-1-piperazinyl)-1H-indoleSCHEMBL4306478LNBPBQCQMJPTQS-UHFFFAOYSA-N4-(4-Methyl-piperazin-1-yl)-1H-indoleDA-22499

Database identifiers

PubChem CID
22015351

Properties

Computed structural properties

XLogP
2.7
Topological polar surface area
22.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
1
Heavy atoms
16
Formal charge
0
Complexity
235

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Related reactions

5 records
New reaction record
HRID 8329 reaction equation
HRID 8329As reactantuspto-grants-2006_08
HRID 2112455 reaction equation
HRID 2112455As reactantuspto-grants-2009_04
HRID 2148471 reaction equation
HRID 2148471As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2151169 reaction equation
HRID 2151169As reactantTraining data from https://doi.org/10.1039/C8SC04228D (4/10)
HRID 2278663 reaction equation
HRID 2278663As reactantuspto-grants-2015_09

Compound notes

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