6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide

C19H18N4O — CID 109126943

IUPAC6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide
SMILESCc1ccc(Nc2ccc(C(=O)Nc3cccc(C)c3)nn2)cc1
InChIInChI=1S/C19H18N4O/c1-13-6-8-15(9-7-13)20-18-11-10-17(22-23-18)19(24)21-16-5-3-4-14(2)12-16/h3-12H,1-2H3,(H,20,23)(H,21,24)
InChIKeyLIYASHVVGFPZDL-UHFFFAOYSA-N
MW318.38 g/mol
LogP4.09
Rot. Bonds4

About 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide

6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide (PubChem CID 109126943) has the molecular formula C19H18N4O and a molecular weight of 318.38 g/mol. Its IUPAC name is 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide
PubChem CID109126943
Molecular FormulaC19H18N4O
Molecular Weight318.38 g/mol
Exact Mass318.15
IUPAC Name6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide
SMILESCc1ccc(Nc2ccc(C(=O)Nc3cccc(C)c3)nn2)cc1
InChIInChI=1S/C19H18N4O/c1-13-6-8-15(9-7-13)20-18-11-10-17(22-23-18)19(24)21-16-5-3-4-14(2)12-16/h3-12H,1-2H3,(H,20,23)(H,21,24)
InChIKeyLIYASHVVGFPZDL-UHFFFAOYSA-N
XLogP4.09
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3-methylanilino)-N-phenylpyridazine-3-carboxamide
CID 109126645
6-(4-methylanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109127010
N-(4-bromophenyl)-6-(3-methylanilino)pyridazine-3-carboxamide
CID 109126897
6-(3-bromoanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide
CID 109126993
N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide
CID 109126899
5-(4-methylanilino)-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109289825
N-tert-butyl-6-(3-methylanilino)pyridazine-3-carboxamide
CID 109124848
N-(4-acetamidophenyl)-6-anilinopyridazine-3-carboxamide
CID 109126601
N-(3-acetylphenyl)-6-(2,5-dimethylanilino)pyridazine-3-carboxamide
CID 109127587
6-[4-(dimethylamino)anilino]-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
CID 109127754
6-(4-chloroanilino)-N-(3-fluorophenyl)pyridazine-3-carboxamide
CID 109128752
6-(3-acetylanilino)-N-(4-acetylphenyl)pyridazine-3-carboxamide
CID 109129785

Frequently Asked Questions

What is the IUPAC name of 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide (CID 109126943) is 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide is Cc1ccc(Nc2ccc(C(=O)Nc3cccc(C)c3)nn2)cc1.
What is the InChIKey of 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide?
The InChIKey is LIYASHVVGFPZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O/c1-13-6-8-15(9-7-13)20-18-11-10-17(22-23-18)19(24)21-16-5-3-4-14(2)12-16/h3-12H,1-2H3,(H,20,23)(H,21,24).
What are the key properties of 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide?
6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide has a molecular weight of 318.38 g/mol, XLogP of 4.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109126943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).