7-Ethyl-9,10-dihydro-2-methyl-4H-benzo[5,6]cyclohepta[1,2-d]oxazol-4-one

HCID 22003584

Basic information

Standard SMILES
CCc1ccc2c(c1)CCc1oc(C)nc1C2=O
InChIKey
FTEJVHUJEROGSW-UHFFFAOYSA-N
Molecular formula
C15H15NO2
Average molar mass
241.28 g/mol

Names & identifiers

Preferred name
7-Ethyl-9,10-dihydro-2-methyl-4H-benzo[5,6]cyclohepta[1,2-d]oxazol-4-one
IUPAC
12-ethyl-5-methyl-6-oxa-4-azatricyclo[8.4.0.03,7]tetradeca-1(10),3(7),4,11,13-pentaen-2-one

Names & synonyms

SCHEMBL7507479FTEJVHUJEROGSW-UHFFFAOYSA-N7-Ethyl-9,10-dihydro-2-methyl-4H-benzo[5,6]cyclohepta[1,2-d]oxazol-4-one7-Ethyl-9,10-dihydro-2-methyl-4H-benzo[5,6]cyclohepta[1,2-d]oxazole-4-one

Database identifiers

PubChem CID
22003584

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
43.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
18

Related reactions

4 records

Linked notes

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