3-(2-fluoroethyl)-1,6-dihydropyridazine

C6H9FN2 — CID 122683484

IUPAC3-(2-fluoroethyl)-1,6-dihydropyridazine
SMILESFCCC1=NNCC=C1
InChIInChI=1S/C6H9FN2/c7-4-3-6-2-1-5-8-9-6/h1-2,8H,3-5H2
InChIKeyRNWWQYMBHCHFRN-UHFFFAOYSA-N
MW128.15 g/mol
LogP0.86
Rot. Bonds2

About 3-(2-fluoroethyl)-1,6-dihydropyridazine

3-(2-fluoroethyl)-1,6-dihydropyridazine (PubChem CID 122683484) has the molecular formula C6H9FN2 and a molecular weight of 128.15 g/mol. Its IUPAC name is 3-(2-fluoroethyl)-1,6-dihydropyridazine.

Molecular Properties

Compound Name3-(2-fluoroethyl)-1,6-dihydropyridazine
PubChem CID122683484
Molecular FormulaC6H9FN2
Molecular Weight128.15 g/mol
Exact Mass128.07
IUPAC Name3-(2-fluoroethyl)-1,6-dihydropyridazine
SMILESFCCC1=NNCC=C1
InChIInChI=1S/C6H9FN2/c7-4-3-6-2-1-5-8-9-6/h1-2,8H,3-5H2
InChIKeyRNWWQYMBHCHFRN-UHFFFAOYSA-N
XLogP0.86
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.15
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-fluoroethyl)-1,6-dihydropyridazine?
The IUPAC name of 3-(2-fluoroethyl)-1,6-dihydropyridazine (CID 122683484) is 3-(2-fluoroethyl)-1,6-dihydropyridazine.
What is the SMILES notation for 3-(2-fluoroethyl)-1,6-dihydropyridazine?
The canonical SMILES for 3-(2-fluoroethyl)-1,6-dihydropyridazine is FCCC1=NNCC=C1.
What is the InChIKey of 3-(2-fluoroethyl)-1,6-dihydropyridazine?
The InChIKey is RNWWQYMBHCHFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2/c7-4-3-6-2-1-5-8-9-6/h1-2,8H,3-5H2.
What are the key properties of 3-(2-fluoroethyl)-1,6-dihydropyridazine?
3-(2-fluoroethyl)-1,6-dihydropyridazine has a molecular weight of 128.15 g/mol, XLogP of 0.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-fluoroethyl)-1,6-dihydropyridazine is sourced from PubChem (CID 122683484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).