1-[4-Amino-5-chloro-2-(3,5-dimethylbenzyloxy)-phenyl]-5-(piperidin-1-yl)pentan-1-one hydrochloride

HCID 19081988
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Basic information

Standard SMILES
Cc1cc(C)cc(COc2cc(N)c(Cl)cc2C(=O)CCCCN2CCCCC2)c1.Cl
InChIKey
YNPLBKXBDVFNBR-UHFFFAOYSA-N
Molecular formula
C25H34Cl2N2O2
Average molar mass
465.5 g/mol
Monoisotopic mass
464.1997337

Names & identifiers

Preferred name
1-[4-Amino-5-chloro-2-(3,5-dimethylbenzyloxy)-phenyl]-5-(piperidin-1-yl)pentan-1-one hydrochloride
IUPAC
1-[4-amino-5-chloro-2-[(3,5-dimethylphenyl)methoxy]phenyl]-5-piperidin-1-ylpentan-1-one;hydrochloride

Names & synonyms

SCHEMBL8599360YNPLBKXBDVFNBR-UHFFFAOYSA-N1-[4-amino-5-chloro-2-(3,5-dimethylbenzyloxy)-phenyl]-5-(piperidin-1-yl)pentan-1-one hydrochloride

Database identifiers

PubChem CID
19081988

Properties

Computed structural properties

Topological polar surface area
55.6 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
9
Heavy atoms
31

Related reactions

1 records
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Linked notes

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