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4-amino-5-chloro-N-(3-hydroxypiperidin-4-yl)-2-methoxybenzamide

HCID 13677753
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Basic information

Standard SMILES
COc1cc(N)c(Cl)cc1C(=O)NC1CCNCC1O
InChIKey
WMBGFYUYJMJVPC-UHFFFAOYSA-N
Molecular formula
C13H18ClN3O3
Average molar mass
299.75 g/mol

Names & identifiers

Preferred name
4-amino-5-chloro-N-(3-hydroxypiperidin-4-yl)-2-methoxybenzamide
IUPAC
4-amino-5-chloro-N-(3-hydroxypiperidin-4-yl)-2-methoxybenzamide

Names & synonyms

SCHEMBL9721646

Database identifiers

PubChem CID
13677753

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
96.6 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
3
Heavy atoms
20
Formal charge
0
Complexity
345

Related reactions

1 records
New reaction record
HRID 957407 reaction equation
HRID 957407As reactantValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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