4-(6-amino-1-isopropyl-1H-indol-3-yl)-benzonitrile

HCID 57442201
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(C)n1cc(-c2ccc(C#N)cc2)c2ccc(N)cc21
InChIKey
DCYDRAYPSYNKTE-UHFFFAOYSA-N
Molecular formula
C18H17N3
Average molar mass
275.3 g/mol

Names & identifiers

Preferred name
4-(6-amino-1-isopropyl-1H-indol-3-yl)-benzonitrile
IUPAC
4-(6-amino-1-propan-2-ylindol-3-yl)benzonitrile

Names & synonyms

SCHEMBL1631816DCYDRAYPSYNKTE-UHFFFAOYSA-N4-(6-amino-1-isopropyl-1H-indol-3-yl)-benzonitrile

Database identifiers

PubChem CID
57442201

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
54.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
21

Related reactions

4 records
New reaction record

Compound notes

Loading…