Tert-butyl 5-(6-chloro-5-methyl-3-pyridinyl)-5-hydroxy-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate

HCID 21892895
NotesReactions
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Basic information

Standard SMILES
Cc1cc(C2(O)CC3CN(C(=O)OC(C)(C)C)CC3C2)cnc1Cl
InChIKey
PVQHTPPGFKTHCH-UHFFFAOYSA-N
Molecular formula
C18H25ClN2O3
Average molar mass
352.9 g/mol
Monoisotopic mass
352.1553704

Names & identifiers

Preferred name
Tert-butyl 5-(6-chloro-5-methyl-3-pyridinyl)-5-hydroxy-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate
IUPAC
tert-butyl 5-(6-chloro-5-methyl-3-pyridinyl)-5-hydroxy-1,3,3a,4,6,6a-hexahydrocyclopenta[c]pyrrole-2-carboxylate

Names & synonyms

SCHEMBL5938116

Database identifiers

PubChem CID
21892895

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
62.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
3
Heavy atoms
24

Related reactions

2 records
New reaction record

Compound notes

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