6-fluorophthalazine

C8H5FN2 — CID 119084530

IUPAC6-fluorophthalazine
SMILESFc1ccc2cnncc2c1
InChIInChI=1S/C8H5FN2/c9-8-2-1-6-4-10-11-5-7(6)3-8/h1-5H
InChIKeyXQFXPSUINBSCSB-UHFFFAOYSA-N
MW148.14 g/mol
LogP1.77
Rot. Bonds

About 6-fluorophthalazine

6-fluorophthalazine (PubChem CID 119084530) has the molecular formula C8H5FN2 and a molecular weight of 148.14 g/mol. Its IUPAC name is 6-fluorophthalazine.

Molecular Properties

Compound Name6-fluorophthalazine
PubChem CID119084530
Molecular FormulaC8H5FN2
Molecular Weight148.14 g/mol
Exact Mass148.04
IUPAC Name6-fluorophthalazine
SMILESFc1ccc2cnncc2c1
InChIInChI=1S/C8H5FN2/c9-8-2-1-6-4-10-11-5-7(6)3-8/h1-5H
InChIKeyXQFXPSUINBSCSB-UHFFFAOYSA-N
XLogP1.77
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.14
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Phthalazine
CID 9207
1-Chlorophthalazine
CID 160793
1-Phthalazinamine
CID 29399
N-[(E)-(3-fluorophenyl)methylideneamino]phthalazin-1-amine
CID 9623343
Cinnoline
CID 9208
5-Aminophthalazine
CID 11228869
4-Phenylpyridazine
CID 6401329
1,6-Dichlorophthalazine
CID 14322333
2-Phthalazin-1-ylguanidine
CID 12785695
1,4-Difluorophthalazine
CID 12045193
4-[(E)-2-(2-fluorophenyl)ethenyl]pyridazine
CID 6327980
6-Methylphthalazine
CID 12679508

Frequently Asked Questions

What is the IUPAC name of 6-fluorophthalazine?
The IUPAC name of 6-fluorophthalazine (CID 119084530) is 6-fluorophthalazine.
What is the SMILES notation for 6-fluorophthalazine?
The canonical SMILES for 6-fluorophthalazine is Fc1ccc2cnncc2c1.
What is the InChIKey of 6-fluorophthalazine?
The InChIKey is XQFXPSUINBSCSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5FN2/c9-8-2-1-6-4-10-11-5-7(6)3-8/h1-5H.
What are the key properties of 6-fluorophthalazine?
6-fluorophthalazine has a molecular weight of 148.14 g/mol, XLogP of 1.77, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluorophthalazine is sourced from PubChem (CID 119084530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).