1-(1,4-Dioxaspiro[4.5]dec-7-ylcarbonyl)-4-(2-pyridinyl)piperazine

HCID 20076682

Basic information

Standard SMILES
O=C(C1CCCC2(C1)OCCO2)N1CCN(c2ccccn2)CC1
InChIKey
IOCBIMBZCZRDLO-UHFFFAOYSA-N
Molecular formula
C18H25N3O3
Average molar mass
331.4 g/mol
Monoisotopic mass
331.18959167

Names & identifiers

Preferred name
1-(1,4-Dioxaspiro[4.5]dec-7-ylcarbonyl)-4-(2-pyridinyl)piperazine
IUPAC
1,4-dioxaspiro[4.5]decan-7-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone

Names & synonyms

SCHEMBL7803644IOCBIMBZCZRDLO-UHFFFAOYSA-N1-(1,4-Dioxaspiro[4.5]dec -7-ylcarbonyl)-4-(2-pyridinyl)piperazine1-(1,4-Dioxaspiro[4.5]dec-7-ylcarbonyl)-4-(2-pyridinyl)piperazine

Database identifiers

PubChem CID
20076682

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
54.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
24

Related reactions

3 records

Compound notes

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