N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide

C17H11ClF2N4O — CID 109128642

IUPACN-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1ccc(Nc2ccc(F)cc2F)nn1
InChIInChI=1S/C17H11ClF2N4O/c18-11-3-1-2-4-13(11)22-17(25)15-7-8-16(24-23-15)21-14-6-5-10(19)9-12(14)20/h1-9H,(H,21,24)(H,22,25)
InChIKeyGOAVSECSBSLFMH-UHFFFAOYSA-N
MW360.75 g/mol
LogP4.40
Rot. Bonds4

About N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide

N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide (PubChem CID 109128642) has the molecular formula C17H11ClF2N4O and a molecular weight of 360.75 g/mol. Its IUPAC name is N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide
PubChem CID109128642
Molecular FormulaC17H11ClF2N4O
Molecular Weight360.75 g/mol
Exact Mass360.06
IUPAC NameN-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide
SMILESO=C(Nc1ccccc1Cl)c1ccc(Nc2ccc(F)cc2F)nn1
InChIInChI=1S/C17H11ClF2N4O/c18-11-3-1-2-4-13(11)22-17(25)15-7-8-16(24-23-15)21-14-6-5-10(19)9-12(14)20/h1-9H,(H,21,24)(H,22,25)
InChIKeyGOAVSECSBSLFMH-UHFFFAOYSA-N
XLogP4.40
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.75
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chlorophenyl)-6-(3-fluoroanilino)pyridazine-3-carboxamide
CID 109128637
6-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridazine-3-carboxamide
CID 109128560
6-(2,4-difluoroanilino)-N-(2-propan-2-yloxyphenyl)pyridazine-3-carboxamide
CID 109129616
6-(4-chloroanilino)-N-(2-chlorophenyl)pyridazine-3-carboxamide
CID 109128614
N-(2,4-difluorophenyl)-6-hydrazinylpyridazine-3-carboxamide
CID 62247776
N-(3-chloro-4-methoxyphenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide
CID 109129078
6-(2,4-difluoroanilino)-N-(2,4-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109129699
N-(2,4-dichlorophenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109129176
N-(2,4-difluorophenyl)-6-[3-(trifluoromethyl)anilino]pyridazine-3-carboxamide
CID 109129753
6-(tert-butylamino)-N-(2,4-difluorophenyl)pyridazine-3-carboxamide
CID 109124809
N-(2,3-dichlorophenyl)-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294513
[6-(2,4-difluoroanilino)pyridazin-3-yl]-pyrrolidin-1-ylmethanone
CID 109112053

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide?
The IUPAC name of N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide (CID 109128642) is N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide?
The canonical SMILES for N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide is O=C(Nc1ccccc1Cl)c1ccc(Nc2ccc(F)cc2F)nn1.
What is the InChIKey of N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide?
The InChIKey is GOAVSECSBSLFMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11ClF2N4O/c18-11-3-1-2-4-13(11)22-17(25)15-7-8-16(24-23-15)21-14-6-5-10(19)9-12(14)20/h1-9H,(H,21,24)(H,22,25).
What are the key properties of N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide?
N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide has a molecular weight of 360.75 g/mol, XLogP of 4.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-6-(2,4-difluoroanilino)pyridazine-3-carboxamide is sourced from PubChem (CID 109128642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).