6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide

C19H17FN4O2 — CID 109128416

IUPAC6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide
SMILESCCOc1ccc(Nc2ccc(C(=O)Nc3ccccc3F)nn2)cc1
InChIInChI=1S/C19H17FN4O2/c1-2-26-14-9-7-13(8-10-14)21-18-12-11-17(23-24-18)19(25)22-16-6-4-3-5-15(16)20/h3-12H,2H2,1H3,(H,21,24)(H,22,25)
InChIKeyBHRSENUIELLYNV-UHFFFAOYSA-N
MW352.37 g/mol
LogP4.01
Rot. Bonds6

About 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide

6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide (PubChem CID 109128416) has the molecular formula C19H17FN4O2 and a molecular weight of 352.37 g/mol. Its IUPAC name is 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide
PubChem CID109128416
Molecular FormulaC19H17FN4O2
Molecular Weight352.37 g/mol
Exact Mass352.13
IUPAC Name6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide
SMILESCCOc1ccc(Nc2ccc(C(=O)Nc3ccccc3F)nn2)cc1
InChIInChI=1S/C19H17FN4O2/c1-2-26-14-9-7-13(8-10-14)21-18-12-11-17(23-24-18)19(25)22-16-6-4-3-5-15(16)20/h3-12H,2H2,1H3,(H,21,24)(H,22,25)
InChIKeyBHRSENUIELLYNV-UHFFFAOYSA-N
XLogP4.01
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.37
LogP ≤ 54.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(4-ethoxyanilino)-N-(4-methoxyphenyl)pyridazine-3-carboxamide
CID 109129382
5-ethoxy-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 146277110
6-(4-ethoxyanilino)-N-propylpyridazine-3-carboxamide
CID 109109333
6-(2-fluoroanilino)-N-(4-methoxyphenyl)pyridazine-3-carboxamide
CID 109128356
N-(2-ethoxyphenyl)-6-(4-ethylanilino)pyridazine-3-carboxamide
CID 109127965
6-(2-cyanoanilino)-N-(4-ethoxyphenyl)pyridazine-3-carboxamide
CID 109129535
6-(4-ethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 109129289
N-butyl-6-(4-ethoxyanilino)pyridazine-3-carboxamide
CID 109110899
ethyl 2-[[6-(4-methoxyanilino)pyridazine-3-carbonyl]amino]benzoate
CID 109129372
1-N-(4-ethoxyphenyl)-4-N-(2-fluorophenyl)benzene-1,4-dicarboxamide
CID 109049866
N-(3,4-difluorophenyl)-6-(2-ethoxyanilino)pyridazine-3-carboxamide
CID 109129455
6-(2-fluoroanilino)-N-(2-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 109128181

Frequently Asked Questions

What is the IUPAC name of 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide (CID 109128416) is 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide is CCOc1ccc(Nc2ccc(C(=O)Nc3ccccc3F)nn2)cc1.
What is the InChIKey of 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide?
The InChIKey is BHRSENUIELLYNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17FN4O2/c1-2-26-14-9-7-13(8-10-14)21-18-12-11-17(23-24-18)19(25)22-16-6-4-3-5-15(16)20/h3-12H,2H2,1H3,(H,21,24)(H,22,25).
What are the key properties of 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide?
6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide has a molecular weight of 352.37 g/mol, XLogP of 4.01, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-ethoxyanilino)-N-(2-fluorophenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109128416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).