(S)-hexahydro-6-phthalimido-2,2-dimethyl-2H-azepine-7-one

HCID 10755636
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Basic information

Standard SMILES
CC1(C)CCC[C@H](N2C(=O)c3ccccc3C2=O)C(=O)N1
InChIKey
UIZGDBLBIYPBEU-LBPRGKRZSA-N
Molecular formula
C16H18N2O3
Average molar mass
286.33 g/mol

Names & identifiers

Preferred name
(S)-hexahydro-6-phthalimido-2,2-dimethyl-2H-azepine-7-one
IUPAC
2-[(3S)-7,7-dimethyl-2-oxoazepan-3-yl]isoindole-1,3-dione

Names & synonyms

SCHEMBL8428561UIZGDBLBIYPBEU-LBPRGKRZSA-N(S)-hexahydro-6-phthalimido-2,2-dimethyl-2H-azepine-7-one

Database identifiers

PubChem CID
10755636

Properties

Computed structural properties

XLogP
1.9
Topological polar surface area
66.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
1
Heavy atoms
21

Related reactions

8 records
New reaction record

Linked notes

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