5-nitro-3-(2-methylaminoethyl)-1H-indole

HCID 68823965
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Basic information

Standard SMILES
CNCCc1c[nH]c2ccc([N+](=O)[O-])cc12
InChIKey
IWLDQHXKUHHZME-UHFFFAOYSA-N
Molecular formula
C11H13N3O2
Average molar mass
219.24 g/mol
Monoisotopic mass
219.10077667

Names & identifiers

Preferred name
5-nitro-3-(2-methylaminoethyl)-1H-indole
IUPAC
N-methyl-2-(5-nitro-1H-indol-3-yl)ethanamine

Names & synonyms

SCHEMBL3877839IWLDQHXKUHHZME-UHFFFAOYSA-N5-nitro-3-(2-methylaminoethyl)-1H-indole

Database identifiers

PubChem CID
68823965

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
73.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
16

Related reactions

2 records
New reaction record

Linked notes

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