3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine

C17H23N7 — CID 171700804

IUPAC3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine
SMILESc1cnc(N2CCN(c3ccc(N4CCCCC4)nn3)CC2)cn1
InChIInChI=1S/C17H23N7/c1-2-8-22(9-3-1)15-4-5-16(21-20-15)23-10-12-24(13-11-23)17-14-18-6-7-19-17/h4-7,14H,1-3,8-13H2
InChIKeyVWWMHTLCIGCKAG-UHFFFAOYSA-N
MW325.42 g/mol
LogP1.58
Rot. Bonds3

About 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine

3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine (PubChem CID 171700804) has the molecular formula C17H23N7 and a molecular weight of 325.42 g/mol. Its IUPAC name is 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine.

Molecular Properties

Compound Name3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine
PubChem CID171700804
Molecular FormulaC17H23N7
Molecular Weight325.42 g/mol
Exact Mass325.20
IUPAC Name3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine
SMILESc1cnc(N2CCN(c3ccc(N4CCCCC4)nn3)CC2)cn1
InChIInChI=1S/C17H23N7/c1-2-8-22(9-3-1)15-4-5-16(21-20-15)23-10-12-24(13-11-23)17-14-18-6-7-19-17/h4-7,14H,1-3,8-13H2
InChIKeyVWWMHTLCIGCKAG-UHFFFAOYSA-N
XLogP1.58
TPSA61.28 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.42
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

2-methyl-4-(4-pyrazin-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine
CID 154853788
2-(4-iodopiperazin-1-yl)pyrazine
CID 143021662
4-(4-pyrazin-2-ylpiperazin-1-yl)phenol
CID 4795412
3-[4-(5-bromopyrimidin-2-yl)piperazin-1-yl]-6-piperidin-1-ylpyridazine
CID 165432773
4-pyrazin-2-ylthiomorpholine
CID 131156249
2-(4-methylsulfanylpiperazin-1-yl)pyrazine
CID 142028272
2-(4-pyrazin-2-yl-1,4-diazepan-1-yl)ethanol
CID 63309595
2-(4-pyrazin-2-ylpiperazin-1-yl)phenol
CID 2572823
[4-(6-piperidin-1-ylpyridazin-3-yl)piperazin-1-yl]-pyridin-3-ylmethanone
CID 122334551
1-pyrazin-2-ylpiperidin-4-one
CID 14156398
3-piperidin-1-yl-6-[4-[5-(trifluoromethyl)-2-pyridinyl]piperazin-1-yl]pyridazine
CID 165433334
2-(4-bromopiperidin-1-yl)pyrazine
CID 80674882

Frequently Asked Questions

What is the IUPAC name of 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine?
The IUPAC name of 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine (CID 171700804) is 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine.
What is the SMILES notation for 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine?
The canonical SMILES for 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine is c1cnc(N2CCN(c3ccc(N4CCCCC4)nn3)CC2)cn1.
What is the InChIKey of 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine?
The InChIKey is VWWMHTLCIGCKAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N7/c1-2-8-22(9-3-1)15-4-5-16(21-20-15)23-10-12-24(13-11-23)17-14-18-6-7-19-17/h4-7,14H,1-3,8-13H2.
What are the key properties of 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine?
3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine has a molecular weight of 325.42 g/mol, XLogP of 1.58, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine is sourced from PubChem (CID 171700804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).