6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide

C19H17ClN4O — CID 109119831

IUPAC6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(NCc3ccc(Cl)cc3)nn2)cc1
InChIInChI=1S/C19H17ClN4O/c1-13-2-8-16(9-3-13)22-19(25)17-10-11-18(24-23-17)21-12-14-4-6-15(20)7-5-14/h2-11H,12H2,1H3,(H,21,24)(H,22,25)
InChIKeyVYUGHUGKJVXBDC-UHFFFAOYSA-N
MW352.83 g/mol
LogP4.30
Rot. Bonds5

About 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide

6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide (PubChem CID 109119831) has the molecular formula C19H17ClN4O and a molecular weight of 352.83 g/mol. Its IUPAC name is 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide
PubChem CID109119831
Molecular FormulaC19H17ClN4O
Molecular Weight352.83 g/mol
Exact Mass352.11
IUPAC Name6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc(NCc3ccc(Cl)cc3)nn2)cc1
InChIInChI=1S/C19H17ClN4O/c1-13-2-8-16(9-3-13)22-19(25)17-10-11-18(24-23-17)21-12-14-4-6-15(20)7-5-14/h2-11H,12H2,1H3,(H,21,24)(H,22,25)
InChIKeyVYUGHUGKJVXBDC-UHFFFAOYSA-N
XLogP4.30
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.83
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(4-chlorophenyl)methylamino]-N-(3,5-dimethylphenyl)pyridazine-3-carboxamide
CID 109119838
6-[(4-chlorophenyl)methylamino]-N-(4-ethoxyphenyl)pyridazine-3-carboxamide
CID 109119854
N-(5-methyl-1,2-oxazol-3-yl)-6-[(4-methylphenyl)methylamino]pyridazine-3-carboxamide
CID 109118580
6-[(4-chlorophenyl)methylamino]pyridazine-3-carboxylic acid
CID 60791679
N-(4-acetamidophenyl)-6-[(4-methoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 109120236
4-methyl-N-[6-[(4-methylphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041076
6-(methylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 62165036
6-(4-methylanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109127010
N-(4-chlorophenyl)-6-methyl-2-[(4-methylphenyl)methylamino]pyrimidine-4-carboxamide
CID 109327842
6-(tert-butylamino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109124730
6-[2-(4-methoxyphenyl)ethylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109122465
N-(3,5-dichlorophenyl)-6-(pyridin-4-ylmethylamino)pyridazine-3-carboxamide
CID 109121355

Frequently Asked Questions

What is the IUPAC name of 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide (CID 109119831) is 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide is Cc1ccc(NC(=O)c2ccc(NCc3ccc(Cl)cc3)nn2)cc1.
What is the InChIKey of 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide?
The InChIKey is VYUGHUGKJVXBDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O/c1-13-2-8-16(9-3-13)22-19(25)17-10-11-18(24-23-17)21-12-14-4-6-15(20)7-5-14/h2-11H,12H2,1H3,(H,21,24)(H,22,25).
What are the key properties of 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide?
6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide has a molecular weight of 352.83 g/mol, XLogP of 4.30, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-chlorophenyl)methylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109119831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).