Synonyms:
Status: Approved (1989)
Entry Type: Small molecule
Molecule Category: UNKNOWN
UNII: 3AZF20DM1T

Structure

InChI Key UCEWGESNIULAGX-UHFFFAOYSA-N
Smile CC(C)NCCCC1(C(N)=O)c2ccccc2-c2ccccc21
InChI
InChI=1S/C20H24N2O/c1-14(2)22-13-7-12-20(19(21)23)17-10-5-3-8-15(17)16-9-4-6-11-18(16)20/h3-6,8-11,14,22H,7,12-13H2,1-2H3,(H2,21,23)

Physicochemical Descriptors

Property Name Value
Molecular Formula C20H24N2O
Molecular Weight 308.43
AlogP 3.22
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 6.0
Polar Surface Area 55.12
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 23.0

Related Entries

Scaffolds

Cross References

Resources Reference
ChEBI 135314
ChEMBL CHEMBL1201242
DrugBank DB00192
DrugCentral 1434
EPA CompTox DTXSID2057819
FDA SRS 3AZF20DM1T
Human Metabolome Database HMDB0014338
PharmGKB PA164754881
PubChem 52195
SureChEMBL SCHEMBL121202
ZINC ZINC000001855421