3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine

C10H11FN2 — CID 10678885

IUPAC3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine
SMILESFc1ccc(C2=NNCCC2)cc1
InChIInChI=1S/C10H11FN2/c11-9-5-3-8(4-6-9)10-2-1-7-12-13-10/h3-6,12H,1-2,7H2
InChIKeyQSKGBKMISSBSJP-UHFFFAOYSA-N
MW178.21 g/mol
LogP1.91
Rot. Bonds1

About 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine

3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine (PubChem CID 10678885) has the molecular formula C10H11FN2 and a molecular weight of 178.21 g/mol. Its IUPAC name is 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine.

Molecular Properties

Compound Name3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine
PubChem CID10678885
Molecular FormulaC10H11FN2
Molecular Weight178.21 g/mol
Exact Mass178.09
IUPAC Name3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine
SMILESFc1ccc(C2=NNCCC2)cc1
InChIInChI=1S/C10H11FN2/c11-9-5-3-8(4-6-9)10-2-1-7-12-13-10/h3-6,12H,1-2,7H2
InChIKeyQSKGBKMISSBSJP-UHFFFAOYSA-N
XLogP1.91
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.21
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine?
The IUPAC name of 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine (CID 10678885) is 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine.
What is the SMILES notation for 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine?
The canonical SMILES for 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine is Fc1ccc(C2=NNCCC2)cc1.
What is the InChIKey of 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine?
The InChIKey is QSKGBKMISSBSJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FN2/c11-9-5-3-8(4-6-9)10-2-1-7-12-13-10/h3-6,12H,1-2,7H2.
What are the key properties of 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine?
3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine has a molecular weight of 178.21 g/mol, XLogP of 1.91, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluorophenyl)-1,4,5,6-tetrahydropyridazine is sourced from PubChem (CID 10678885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).