4-[4-(1,5-dimethyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl-3'-yl]-benzylamine

HCID 59322009
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Basic information

Standard SMILES
Cc1c(CN2CCN(c3nccnc3-c3ccc(CN)cc3)CC2)cnn1C
InChIKey
DJDRHSSTEZCPCC-UHFFFAOYSA-N
Molecular formula
C21H27N7
Average molar mass
377.5 g/mol

Names & identifiers

Preferred name
4-[4-(1,5-dimethyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl-3'-yl]-benzylamine
IUPAC
[4-[3-[4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazin-1-yl]pyrazin-2-yl]phenyl]methanamine

Names & synonyms

SCHEMBL3320540DJDRHSSTEZCPCC-UHFFFAOYSA-N4-[4-(1,5-dimethyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl-3'-yl]-benzylamine

Database identifiers

PubChem CID
59322009

Properties

Computed structural properties

XLogP
0.8
Topological polar surface area
76.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
5
Heavy atoms
28

Related reactions

9 records
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Linked notes

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