3-Fluoro-N-{4-[(2-{[1-(hydroxymethyl)cyclopentyl]amino}pyrimidin-4-yl)oxy]-1-naphthyl}-5-piperidin-1-ylbenzamide

HCID 59553331

Basic information

Standard SMILES
O=C(Nc1ccc(Oc2ccnc(NC3(CO)CCCC3)n2)c2ccccc12)c1cc(F)cc(N2CCCCC2)c1
InChIKey
OICCEOXHGBJYGG-UHFFFAOYSA-N
Molecular formula
C32H34FN5O3
Average molar mass
555.6 g/mol

Names & identifiers

Preferred name
3-Fluoro-N-{4-[(2-{[1-(hydroxymethyl)cyclopentyl]amino}pyrimidin-4-yl)oxy]-1-naphthyl}-5-piperidin-1-ylbenzamide
IUPAC
3-fluoro-N-[4-[2-[[1-(hydroxymethyl)cyclopentyl]amino]pyrimidin-4-yl]oxynaphthalen-1-yl]-5-piperidin-1-ylbenzamide

Names & synonyms

SCHEMBL592774OICCEOXHGBJYGG-UHFFFAOYSA-N3-Fluoro-N-{4-[(2-{[1-(hydroxymethyl)cyclopentyl]amino}pyrimidin-4-yl)oxy]-1-naphthyl}-5-piperidin-1-ylbenzamide

Database identifiers

PubChem CID
59553331

Properties

Computed structural properties

XLogP
5.9
Topological polar surface area
99.6 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
8
Rotatable bonds
8
Heavy atoms
41

Related reactions

3 records

Linked notes

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