3-ethyl-4-fluoro-1,2-dihydropyridazine

C6H9FN2 — CID 146392496

IUPAC3-ethyl-4-fluoro-1,2-dihydropyridazine
SMILESCCC1=C(F)C=CNN1
InChIInChI=1S/C6H9FN2/c1-2-6-5(7)3-4-8-9-6/h3-4,8-9H,2H2,1H3
InChIKeyPTDSGMAPSQCLPK-UHFFFAOYSA-N
MW128.15 g/mol
LogP1.20
Rot. Bonds1

About 3-ethyl-4-fluoro-1,2-dihydropyridazine

3-ethyl-4-fluoro-1,2-dihydropyridazine (PubChem CID 146392496) has the molecular formula C6H9FN2 and a molecular weight of 128.15 g/mol. Its IUPAC name is 3-ethyl-4-fluoro-1,2-dihydropyridazine.

Molecular Properties

Compound Name3-ethyl-4-fluoro-1,2-dihydropyridazine
PubChem CID146392496
Molecular FormulaC6H9FN2
Molecular Weight128.15 g/mol
Exact Mass128.07
IUPAC Name3-ethyl-4-fluoro-1,2-dihydropyridazine
SMILESCCC1=C(F)C=CNN1
InChIInChI=1S/C6H9FN2/c1-2-6-5(7)3-4-8-9-6/h3-4,8-9H,2H2,1H3
InChIKeyPTDSGMAPSQCLPK-UHFFFAOYSA-N
XLogP1.20
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.15
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4-fluoro-1,2-dihydropyridazine?
The IUPAC name of 3-ethyl-4-fluoro-1,2-dihydropyridazine (CID 146392496) is 3-ethyl-4-fluoro-1,2-dihydropyridazine.
What is the SMILES notation for 3-ethyl-4-fluoro-1,2-dihydropyridazine?
The canonical SMILES for 3-ethyl-4-fluoro-1,2-dihydropyridazine is CCC1=C(F)C=CNN1.
What is the InChIKey of 3-ethyl-4-fluoro-1,2-dihydropyridazine?
The InChIKey is PTDSGMAPSQCLPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FN2/c1-2-6-5(7)3-4-8-9-6/h3-4,8-9H,2H2,1H3.
What are the key properties of 3-ethyl-4-fluoro-1,2-dihydropyridazine?
3-ethyl-4-fluoro-1,2-dihydropyridazine has a molecular weight of 128.15 g/mol, XLogP of 1.20, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4-fluoro-1,2-dihydropyridazine is sourced from PubChem (CID 146392496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).