N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide

C19H16F2N4O — CID 109128062

IUPACN-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide
SMILESCCN(c1ccccc1)c1ccc(C(=O)Nc2ccc(F)cc2F)nn1
InChIInChI=1S/C19H16F2N4O/c1-2-25(14-6-4-3-5-7-14)18-11-10-17(23-24-18)19(26)22-16-9-8-13(20)12-15(16)21/h3-12H,2H2,1H3,(H,22,26)
InChIKeyRJBKRBYZBVSQBS-UHFFFAOYSA-N
MW354.36 g/mol
LogP4.17
Rot. Bonds5

About N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide

N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide (PubChem CID 109128062) has the molecular formula C19H16F2N4O and a molecular weight of 354.36 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide
PubChem CID109128062
Molecular FormulaC19H16F2N4O
Molecular Weight354.36 g/mol
Exact Mass354.13
IUPAC NameN-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide
SMILESCCN(c1ccccc1)c1ccc(C(=O)Nc2ccc(F)cc2F)nn1
InChIInChI=1S/C19H16F2N4O/c1-2-25(14-6-4-3-5-7-14)18-11-10-17(23-24-18)19(26)22-16-9-8-13(20)12-15(16)21/h3-12H,2H2,1H3,(H,22,26)
InChIKeyRJBKRBYZBVSQBS-UHFFFAOYSA-N
XLogP4.17
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.36
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-difluorophenyl)-5-(N-methylanilino)pyridine-2-carboxamide
CID 109197711
N-(4-ethoxyphenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide
CID 109128038
6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide
CID 109128041
4-[benzyl(ethyl)amino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide
CID 109212657
6-(N-ethylanilino)-N-(4-fluorophenyl)-2-methylpyrimidine-4-carboxamide
CID 112849476
2-(N-ethylanilino)-N-(2-fluorophenyl)-6-methylpyrimidine-4-carboxamide
CID 109336352
N-(2,4-difluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62247776
6-(tert-butylamino)-N-(2,4-difluorophenyl)pyridazine-3-carboxamide
CID 109124809
5-anilino-N-(2,4-difluorophenyl)pyridine-2-carboxamide
CID 109197129
1-benzyl-N-(2,4-difluorophenyl)triazole-4-carboxamide
CID 18152169
6-[butyl(methyl)amino]-N-(2,4-difluorophenyl)-2-methylpyrimidine-4-carboxamide
CID 112846999
6-N-(2,4-difluorophenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109100019

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide (CID 109128062) is N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide is CCN(c1ccccc1)c1ccc(C(=O)Nc2ccc(F)cc2F)nn1.
What is the InChIKey of N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide?
The InChIKey is RJBKRBYZBVSQBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2N4O/c1-2-25(14-6-4-3-5-7-14)18-11-10-17(23-24-18)19(26)22-16-9-8-13(20)12-15(16)21/h3-12H,2H2,1H3,(H,22,26).
What are the key properties of N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide?
N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide has a molecular weight of 354.36 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide is sourced from PubChem (CID 109128062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).