3,8-Diazabicyclo(3.2.1)octane, 8-(p-chlorobenzoyl)-3-methyl-

HCID 45841

Notes Reactions

Substructure search Find similar structures

Basic information

CAS: 63978-15-4
Standard SMILES: CN1CC2CCC(C1)N2C(=O)c1ccc(Cl)cc1
InChIKey: FZVUISTUCPQRLS-UHFFFAOYSA-N
Molecular formula: C14H17ClN2O
Average molar mass: 264.75 g/mol
Monoisotopic mass: 264.1029409

Names & identifiers

Preferred name: 3,8-Diazabicyclo(3.2.1)octane, 8-(p-chlorobenzoyl)-3-methyl-
IUPAC: (4-chlorophenyl)-(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)methanone

Names & synonyms

8-(p-Chlorobenzoyl)-3-methyl-3,8-diazabicyclo(3.2.1)octane63978-15-43,8-DIAZABICYCLO(3.2.1)OCTANE, 8-(p-CHLOROBENZOYL)-3-METHYL-RefChem:272716DTXSID60981462(4-Chlorophenyl)(3-methyl-3,8-diazabicyclo[3.2.1]octan-8-yl)methanone

Database identifiers

CAS: 63978-15-4
PubChem CID: 45841
DTXSID: DTXSID60981462
Nikkaji: J68.412K

Properties

Computed structural properties

XLogP: 2.4
Topological polar surface area: 23.6 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 2
Rotatable bonds: 1
Heavy atoms: 18
Formal charge: 0
Complexity: 314

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…