3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine

C14H15FN4 — CID 69351973

IUPAC3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine
SMILESFc1ccc(N2CCN(c3cccnn3)CC2)cc1
InChIInChI=1S/C14H15FN4/c15-12-3-5-13(6-4-12)18-8-10-19(11-9-18)14-2-1-7-16-17-14/h1-7H,8-11H2
InChIKeyAPNASKVMZVMLQF-UHFFFAOYSA-N
MW258.30 g/mol
LogP1.94
Rot. Bonds2

About 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine

3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine (PubChem CID 69351973) has the molecular formula C14H15FN4 and a molecular weight of 258.30 g/mol. Its IUPAC name is 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine.

Molecular Properties

Compound Name3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine
PubChem CID69351973
Molecular FormulaC14H15FN4
Molecular Weight258.30 g/mol
Exact Mass258.13
IUPAC Name3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine
SMILESFc1ccc(N2CCN(c3cccnn3)CC2)cc1
InChIInChI=1S/C14H15FN4/c15-12-3-5-13(6-4-12)18-8-10-19(11-9-18)14-2-1-7-16-17-14/h1-7H,8-11H2
InChIKeyAPNASKVMZVMLQF-UHFFFAOYSA-N
XLogP1.94
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine?
The IUPAC name of 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine (CID 69351973) is 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine.
What is the SMILES notation for 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine?
The canonical SMILES for 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine is Fc1ccc(N2CCN(c3cccnn3)CC2)cc1.
What is the InChIKey of 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine?
The InChIKey is APNASKVMZVMLQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN4/c15-12-3-5-13(6-4-12)18-8-10-19(11-9-18)14-2-1-7-16-17-14/h1-7H,8-11H2.
What are the key properties of 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine?
3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine has a molecular weight of 258.30 g/mol, XLogP of 1.94, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(4-fluorophenyl)piperazin-1-yl]pyridazine is sourced from PubChem (CID 69351973), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).