6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide

C24H16FN3O3 — CID 133313243

IUPAC6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide
SMILESO=C(c1ccc(F)cc1)c1ccc(Oc2ccc(C(=O)Nc3ccccc3)nn2)cc1
InChIInChI=1S/C24H16FN3O3/c25-18-10-6-16(7-11-18)23(29)17-8-12-20(13-9-17)31-22-15-14-21(27-28-22)24(30)26-19-4-2-1-3-5-19/h1-15H,(H,26,30)
InChIKeyVRHYGOVLBXITNF-UHFFFAOYSA-N
MW413.41 g/mol
LogP4.89
Rot. Bonds6

About 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide

6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide (PubChem CID 133313243) has the molecular formula C24H16FN3O3 and a molecular weight of 413.41 g/mol. Its IUPAC name is 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide
PubChem CID133313243
Molecular FormulaC24H16FN3O3
Molecular Weight413.41 g/mol
Exact Mass413.12
IUPAC Name6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide
SMILESO=C(c1ccc(F)cc1)c1ccc(Oc2ccc(C(=O)Nc3ccccc3)nn2)cc1
InChIInChI=1S/C24H16FN3O3/c25-18-10-6-16(7-11-18)23(29)17-8-12-20(13-9-17)31-22-15-14-21(27-28-22)24(30)26-19-4-2-1-3-5-19/h1-15H,(H,26,30)
InChIKeyVRHYGOVLBXITNF-UHFFFAOYSA-N
XLogP4.89
TPSA81.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.41
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 133313253
4-benzoyl-N-(4-fluorophenyl)benzamide
CID 2315903
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CID 133459492
4-fluoro-N-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]oxyphenyl]benzamide
CID 122305014
N-(4-fluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62249751
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CID 122307912
N-[4-[6-(4-fluorophenyl)pyridazin-3-yl]oxyphenyl]thiophene-3-carboxamide
CID 133288175
N-(4-phenoxyphenyl)-6-propan-2-ylpyridazine-3-carboxamide
CID 113200474
6-amino-N-(4-fluorophenyl)pyridazine-3-carboxamide
CID 62155228
N-[4-(6-methylpyridazin-3-yl)oxyphenyl]naphthalene-2-carboxamide
CID 70703281
(4-fluorophenyl)-phenylmethanone
CID 161464622
6-(4-chlorophenoxy)pyridazine-3-carboxylic acid
CID 60791476

Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide?
The IUPAC name of 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide (CID 133313243) is 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide?
The canonical SMILES for 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide is O=C(c1ccc(F)cc1)c1ccc(Oc2ccc(C(=O)Nc3ccccc3)nn2)cc1.
What is the InChIKey of 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide?
The InChIKey is VRHYGOVLBXITNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN3O3/c25-18-10-6-16(7-11-18)23(29)17-8-12-20(13-9-17)31-22-15-14-21(27-28-22)24(30)26-19-4-2-1-3-5-19/h1-15H,(H,26,30).
What are the key properties of 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide?
6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide has a molecular weight of 413.41 g/mol, XLogP of 4.89, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-fluorobenzoyl)phenoxy]-N-phenylpyridazine-3-carboxamide is sourced from PubChem (CID 133313243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).