6-[4-(4-Cyclohexyl-piperazin-1-ylmethyl)-phenoxy]-nicotinamide

HCID 59729991
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Basic information

Standard SMILES
NC(=O)c1ccc(Oc2ccc(CN3CCN(C4CCCCC4)CC3)cc2)nc1
InChIKey
IJNIJCKWTZHJEB-UHFFFAOYSA-N
Molecular formula
C23H30N4O2
Average molar mass
394.5 g/mol
Monoisotopic mass
394.23687621

Names & identifiers

Preferred name
6-[4-(4-Cyclohexyl-piperazin-1-ylmethyl)-phenoxy]-nicotinamide
IUPAC
6-[4-[(4-cyclohexylpiperazin-1-yl)methyl]phenoxy]pyridine-3-carboxamide

Names & synonyms

SCHEMBL3705252IJNIJCKWTZHJEB-UHFFFAOYSA-N6-[4-(4-Cyclohexyl-piperazin-1-ylmethyl)-phenoxy]-nicotinamide

Database identifiers

PubChem CID
59729991

Properties

Computed structural properties

XLogP
3
Topological polar surface area
71.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
29

Related reactions

4 records
New reaction record

Linked notes

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