1-{4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl}-1H-pyrazole

HCID 11044366
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Basic information

Standard SMILES
c1cnc(N2CCN(CCCCn3cccn3)CC2)nc1
InChIKey
MVLCWTIFKARXPZ-UHFFFAOYSA-N
Molecular formula
C15H22N6
Average molar mass
286.38 g/mol
Monoisotopic mass
286.19059473

Names & identifiers

Preferred name
1-{4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl}-1H-pyrazole
IUPAC
2-[4-(4-pyrazol-1-ylbutyl)piperazin-1-yl]pyrimidine

Names & synonyms

SCHEMBL8416486MVLCWTIFKARXPZ-UHFFFAOYSA-NL0040541-{4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl}-1H-pyrazole

Database identifiers

PubChem CID
11044366

Properties

Computed structural properties

XLogP
1.1
Topological polar surface area
50.1 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
6
Heavy atoms
21

Related reactions

4 records
New reaction record

Compound notes

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1-{4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl}-1H-pyrazole (HCID 11044366)｜Huagongshe