2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide

C19H17ClN4O2 — CID 113048567

IUPAC2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide
SMILESCOc1ccc(C)cc1Nc1ccc(NC(=O)c2ccccc2Cl)nn1
InChIInChI=1S/C19H17ClN4O2/c1-12-7-8-16(26-2)15(11-12)21-17-9-10-18(24-23-17)22-19(25)13-5-3-4-6-14(13)20/h3-11H,1-2H3,(H,21,23)(H,22,24,25)
InChIKeyGIJDCHCHRUHCAI-UHFFFAOYSA-N
MW368.82 g/mol
LogP4.44
Rot. Bonds5

About 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide

2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide (PubChem CID 113048567) has the molecular formula C19H17ClN4O2 and a molecular weight of 368.82 g/mol. Its IUPAC name is 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide
PubChem CID113048567
Molecular FormulaC19H17ClN4O2
Molecular Weight368.82 g/mol
Exact Mass368.10
IUPAC Name2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide
SMILESCOc1ccc(C)cc1Nc1ccc(NC(=O)c2ccccc2Cl)nn1
InChIInChI=1S/C19H17ClN4O2/c1-12-7-8-16(26-2)15(11-12)21-17-9-10-18(24-23-17)22-19(25)13-5-3-4-6-14(13)20/h3-11H,1-2H3,(H,21,23)(H,22,24,25)
InChIKeyGIJDCHCHRUHCAI-UHFFFAOYSA-N
XLogP4.44
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.82
LogP ≤ 54.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-6-fluoro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide
CID 113048572
N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]acetamide
CID 113048531
6-(2-methoxyanilino)-N-(2-methoxy-5-methylphenyl)pyridazine-3-carboxamide
CID 109129147
N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]-2-(2-methylphenyl)acetamide
CID 113048579
N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]-2-(4-methylphenyl)acetamide
CID 113048581
N-[6-(3,5-dichloroanilino)pyridazin-3-yl]-2-methoxybenzamide
CID 113050853
N-(2-chlorophenyl)-5-(2-methoxy-5-methylanilino)pyrazine-2-carboxamide
CID 109292615
N-(2-cyanophenyl)-6-(2-methoxy-5-methylanilino)pyridazine-3-carboxamide
CID 109129563
6-(2-methoxy-5-methylanilino)-N-(4-methoxyphenyl)pyridazine-3-carboxamide
CID 109129383
N-[6-(4-chloroanilino)pyridazin-3-yl]-2-methoxybenzamide
CID 113047536
5-(2-chloroanilino)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109292670
N-[6-(4-chloro-2-methoxy-5-methylanilino)pyridazin-3-yl]furan-2-carboxamide
CID 113050980

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide?
The IUPAC name of 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide (CID 113048567) is 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide?
The canonical SMILES for 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide is COc1ccc(C)cc1Nc1ccc(NC(=O)c2ccccc2Cl)nn1.
What is the InChIKey of 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide?
The InChIKey is GIJDCHCHRUHCAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17ClN4O2/c1-12-7-8-16(26-2)15(11-12)21-17-9-10-18(24-23-17)22-19(25)13-5-3-4-6-14(13)20/h3-11H,1-2H3,(H,21,23)(H,22,24,25).
What are the key properties of 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide?
2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide has a molecular weight of 368.82 g/mol, XLogP of 4.44, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[6-(2-methoxy-5-methylanilino)pyridazin-3-yl]benzamide is sourced from PubChem (CID 113048567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).