Tert-butyl 3-(1-methylbenzimidazol-2-yl)azetidine-1-carboxylate

HCID 44239658
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
Cn1c(C2CN(C(=O)OC(C)(C)C)C2)nc2ccccc21
InChIKey
QYKQPQSZTOJOLV-UHFFFAOYSA-N
Molecular formula
C16H21N3O2
Average molar mass
287.36 g/mol
Monoisotopic mass
287.16337692

Names & identifiers

Preferred name
Tert-butyl 3-(1-methylbenzimidazol-2-yl)azetidine-1-carboxylate
IUPAC
tert-butyl 3-(1-methylbenzimidazol-2-yl)azetidine-1-carboxylate

Database identifiers

PubChem CID
44239658

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
47.4 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
21

Related reactions

1 records
New reaction record

Compound notes

Loading…