6-{trans-[4-(2-methyl-3-phenylpropylamino)-cyclohexyl]}-3H-benzoxazol-2-one

HCID 22669136
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(CNC1CCC(c2ccc3[nH]c(=O)oc3c2)CC1)Cc1ccccc1
InChIKey
HTCOZVLMTGWFAW-UHFFFAOYSA-N
Molecular formula
C23H28N2O2
Average molar mass
364.5 g/mol

Names & identifiers

Preferred name
6-{trans-[4-(2-methyl-3-phenylpropylamino)-cyclohexyl]}-3H-benzoxazol-2-one
IUPAC
6-[4-[(2-methyl-3-phenylpropyl)amino]cyclohexyl]-3H-1,3-benzoxazol-2-one

Names & synonyms

SCHEMBL6191352SCHEMBL6191358HTCOZVLMTGWFAW-WTXWRMNVSA-N6-{trans-[4-(2-methyl-3-phenylpropylamino)-cyclohexyl]}-3H-benzoxazol-2-one

Database identifiers

PubChem CID
22669136

Properties

Computed structural properties

XLogP
4.8
Topological polar surface area
50.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
27

Related reactions

1 records
New reaction record

Compound notes

Loading…