3-ethyl-6-fluoropyridazine

C6H7FN2 — CID 21030397

IUPAC3-ethyl-6-fluoropyridazine
SMILESCCc1ccc(F)nn1
InChIInChI=1S/C6H7FN2/c1-2-5-3-4-6(7)9-8-5/h3-4H,2H2,1H3
InChIKeyNNMAGRZPFUJWSN-UHFFFAOYSA-N
MW126.13 g/mol
LogP1.18
Rot. Bonds1

About 3-ethyl-6-fluoropyridazine

3-ethyl-6-fluoropyridazine (PubChem CID 21030397) has the molecular formula C6H7FN2 and a molecular weight of 126.13 g/mol. Its IUPAC name is 3-ethyl-6-fluoropyridazine.

Molecular Properties

Compound Name3-ethyl-6-fluoropyridazine
PubChem CID21030397
Molecular FormulaC6H7FN2
Molecular Weight126.13 g/mol
Exact Mass126.06
IUPAC Name3-ethyl-6-fluoropyridazine
SMILESCCc1ccc(F)nn1
InChIInChI=1S/C6H7FN2/c1-2-5-3-4-6(7)9-8-5/h3-4H,2H2,1H3
InChIKeyNNMAGRZPFUJWSN-UHFFFAOYSA-N
XLogP1.18
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.13
LogP ≤ 51.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-6-fluoropyridazine?
The IUPAC name of 3-ethyl-6-fluoropyridazine (CID 21030397) is 3-ethyl-6-fluoropyridazine.
What is the SMILES notation for 3-ethyl-6-fluoropyridazine?
The canonical SMILES for 3-ethyl-6-fluoropyridazine is CCc1ccc(F)nn1.
What is the InChIKey of 3-ethyl-6-fluoropyridazine?
The InChIKey is NNMAGRZPFUJWSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7FN2/c1-2-5-3-4-6(7)9-8-5/h3-4H,2H2,1H3.
What are the key properties of 3-ethyl-6-fluoropyridazine?
3-ethyl-6-fluoropyridazine has a molecular weight of 126.13 g/mol, XLogP of 1.18, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-6-fluoropyridazine is sourced from PubChem (CID 21030397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).