N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide

C12H9Cl2N3O — CID 110705384

IUPACN-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cccc(Cl)c2Cl)nn1
InChIInChI=1S/C12H9Cl2N3O/c1-7-5-6-10(17-16-7)12(18)15-9-4-2-3-8(13)11(9)14/h2-6H,1H3,(H,15,18)
InChIKeyZBCXKTWFKGDVFN-UHFFFAOYSA-N
MW282.13 g/mol
LogP3.34
Rot. Bonds2

About N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide

N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide (PubChem CID 110705384) has the molecular formula C12H9Cl2N3O and a molecular weight of 282.13 g/mol. Its IUPAC name is N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide
PubChem CID110705384
Molecular FormulaC12H9Cl2N3O
Molecular Weight282.13 g/mol
Exact Mass281.01
IUPAC NameN-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide
SMILESCc1ccc(C(=O)Nc2cccc(Cl)c2Cl)nn1
InChIInChI=1S/C12H9Cl2N3O/c1-7-5-6-10(17-16-7)12(18)15-9-4-2-3-8(13)11(9)14/h2-6H,1H3,(H,15,18)
InChIKeyZBCXKTWFKGDVFN-UHFFFAOYSA-N
XLogP3.34
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.13
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dichlorophenyl)-6-phenylpyridazine-3-carboxamide
CID 113200687
6-chloro-N-(3-chloro-2-methylphenyl)pyridazine-3-carboxamide
CID 54927236
6-(4-acetylpiperazin-1-yl)-N-(2,3-dichlorophenyl)pyridazine-3-carboxamide
CID 109117200
N-(2,3-dichlorophenyl)-2-methyl-1,3-oxazole-4-carboxamide
CID 30402707
N-(2,3-dichlorophenyl)-4,6-dimethylpyrimidine-5-carboxamide
CID 110864422
N-(2,6-difluorophenyl)-6-methylpyridazine-3-carboxamide
CID 110705395
6-[(2,3-dichlorophenyl)carbamoyl]pyridine-2-carboxylic acid
CID 43558439
N-(2,3-dichlorophenyl)-1-methylpyrazole-3-carboxamide
CID 42110981
6-methyl-N-(2-phenoxyphenyl)pyridazine-3-carboxamide
CID 110705367
N-(3-chloro-2-methylphenyl)-6-methylpyridine-2-carboxamide
CID 31759188
N-(2,3-dichlorophenyl)-6-(4-formylpiperazin-1-yl)pyridazine-3-carboxamide
CID 109116912
N-(2,3-dichlorophenyl)-6-(3-methylpiperidin-1-yl)pyridazine-3-carboxamide
CID 109126021

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide?
The IUPAC name of N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide (CID 110705384) is N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide.
What is the SMILES notation for N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide?
The canonical SMILES for N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide is Cc1ccc(C(=O)Nc2cccc(Cl)c2Cl)nn1.
What is the InChIKey of N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide?
The InChIKey is ZBCXKTWFKGDVFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2N3O/c1-7-5-6-10(17-16-7)12(18)15-9-4-2-3-8(13)11(9)14/h2-6H,1H3,(H,15,18).
What are the key properties of N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide?
N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide has a molecular weight of 282.13 g/mol, XLogP of 3.34, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dichlorophenyl)-6-methylpyridazine-3-carboxamide is sourced from PubChem (CID 110705384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).