N-(4-(Chlorodifluoromethoxy)phenyl)-6-(3-hydroxy-3-methylpyrrolidin-1-yl)-5-(1H-pyrazol-5-yl)nicotinamide

HCID 89908076
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Basic information

Standard SMILES
CC1(O)CCN(c2ncc(C(=O)Nc3ccc(OC(F)(F)Cl)cc3)cc2-c2ccn[nH]2)C1
InChIKey
ANZVSVJXLRSKGN-UHFFFAOYSA-N
Molecular formula
C21H20ClF2N5O3
Average molar mass
463.9 g/mol

Names & identifiers

Preferred name
N-(4-(Chlorodifluoromethoxy)phenyl)-6-(3-hydroxy-3-methylpyrrolidin-1-yl)-5-(1H-pyrazol-5-yl)nicotinamide
IUPAC
N-[4-[chloro(difluoro)methoxy]phenyl]-6-(3-hydroxy-3-methylpyrrolidin-1-yl)-5-(1H-pyrazol-5-yl)pyridine-3-carboxamide

Names & synonyms

N-(4-(Chlorodifluoromethoxy)phenyl)-6-(3-hydroxy-3-methylpyrrolidin-1-yl)-5-(1H-pyrazol-5-yl)nicotinamideCHEMBL3926537SCHEMBL15393174BDBM230795US9340537, 49

Database identifiers

PubChem CID
89908076
ChEMBL
CHEMBL3926537

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
103 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
6
Heavy atoms
32

Related reactions

1 records
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Linked notes

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