(S)-N-[[[1-Azabicyclo[2.2.2]octan-3-yl]amino]carbonyl]-2-methoxybenzamide

HCID 15616384
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Basic information

Standard SMILES
COc1ccccc1C(=O)NC(=O)N[C@@H]1CN2CCC1CC2
InChIKey
HMKDNNXFHIJZJQ-CYBMUJFWSA-N
Molecular formula
C16H21N3O3
Average molar mass
303.36 g/mol

Names & identifiers

Preferred name
(S)-N-[[[1-Azabicyclo[2.2.2]octan-3-yl]amino]carbonyl]-2-methoxybenzamide
IUPAC
N-[[(3S)-1-azabicyclo[2.2.2]octan-3-yl]carbamoyl]-2-methoxybenzamide

Names & synonyms

SCHEMBL9731329CHEMBL3545947HMKDNNXFHIJZJQ-CYBMUJFWSA-N(S)-N-[[[1-Azabicyclo[2.2.2]octan-3-yl] amino]carbonyl]-2-methoxybenzamide(S)-N-[[[1-Azabicyclo[2.2.2]octan-3-yl]amino]carbonyl]-2-methoxybenzamide

Database identifiers

PubChem CID
15616384
ChEMBL
CHEMBL3545947
Nikkaji
J485.996K

Properties

Computed structural properties

XLogP
2
Topological polar surface area
70.7 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
22

Related reactions

2 records
New reaction record

Linked notes

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