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

C18H16N4O — CID 113045593

IUPACN-[6-(2-methylanilino)pyridazin-3-yl]benzamide
SMILESCc1ccccc1Nc1ccc(NC(=O)c2ccccc2)nn1
InChIInChI=1S/C18H16N4O/c1-13-7-5-6-10-15(13)19-16-11-12-17(22-21-16)20-18(23)14-8-3-2-4-9-14/h2-12H,1H3,(H,19,21)(H,20,22,23)
InChIKeyOAKLSWXKDMQFCV-UHFFFAOYSA-N
MW304.35 g/mol
LogP3.78
Rot. Bonds4

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

N-[6-(2-methylanilino)pyridazin-3-yl]benzamide (PubChem CID 113045593) has the molecular formula C18H16N4O and a molecular weight of 304.35 g/mol. Its IUPAC name is N-[6-(2-methylanilino)pyridazin-3-yl]benzamide.

Molecular Properties

Compound NameN-[6-(2-methylanilino)pyridazin-3-yl]benzamide
PubChem CID113045593
Molecular FormulaC18H16N4O
Molecular Weight304.35 g/mol
Exact Mass304.13
IUPAC NameN-[6-(2-methylanilino)pyridazin-3-yl]benzamide
SMILESCc1ccccc1Nc1ccc(NC(=O)c2ccccc2)nn1
InChIInChI=1S/C18H16N4O/c1-13-7-5-6-10-15(13)19-16-11-12-17(22-21-16)20-18(23)14-8-3-2-4-9-14/h2-12H,1H3,(H,19,21)(H,20,22,23)
InChIKeyOAKLSWXKDMQFCV-UHFFFAOYSA-N
XLogP3.78
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-[6-(2-methylanilino)pyridazin-3-yl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-fluoro-N-[6-(2-methylanilino)pyridazin-3-yl]benzamide
CID 113045599
3-methoxy-N-[6-(2-methylanilino)pyridazin-3-yl]benzamide
CID 113045604
N-[6-(2-methylanilino)pyridazin-3-yl]propanamide
CID 113045581
N-[6-(2-propan-2-yloxyanilino)pyridazin-3-yl]benzamide
CID 113048623
ethyl N-[6-(2-methylanilino)pyridazin-3-yl]carbamate
CID 113045640
N-(4-acetylphenyl)-6-(2-methylanilino)pyridazine-3-carboxamide
CID 109126778
N-[6-[4-(dimethylamino)anilino]pyridazin-3-yl]benzamide
CID 113049582
N-(6-chloropyridazin-3-yl)benzamide
CID 13125576
4-methyl-N-[6-(2-propan-2-yloxyanilino)pyridazin-3-yl]benzamide
CID 113048626
N-benzyl-6-(2-methylanilino)pyridazine-3-carboxamide
CID 109117896
4-methyl-N-[5-(2-methylanilino)-2-pyridinyl]benzamide
CID 113031308
methyl 2-[[6-[(4-methoxybenzoyl)amino]pyridazin-3-yl]amino]benzoate
CID 113049352

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-methylanilino)pyridazin-3-yl]benzamide?
The IUPAC name of N-[6-(2-methylanilino)pyridazin-3-yl]benzamide (CID 113045593) is N-[6-(2-methylanilino)pyridazin-3-yl]benzamide.
What is the SMILES notation for N-[6-(2-methylanilino)pyridazin-3-yl]benzamide?
The canonical SMILES for N-[6-(2-methylanilino)pyridazin-3-yl]benzamide is Cc1ccccc1Nc1ccc(NC(=O)c2ccccc2)nn1.
What is the InChIKey of N-[6-(2-methylanilino)pyridazin-3-yl]benzamide?
The InChIKey is OAKLSWXKDMQFCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N4O/c1-13-7-5-6-10-15(13)19-16-11-12-17(22-21-16)20-18(23)14-8-3-2-4-9-14/h2-12H,1H3,(H,19,21)(H,20,22,23).
What are the key properties of N-[6-(2-methylanilino)pyridazin-3-yl]benzamide?
N-[6-(2-methylanilino)pyridazin-3-yl]benzamide has a molecular weight of 304.35 g/mol, XLogP of 3.78, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-methylanilino)pyridazin-3-yl]benzamide is sourced from PubChem (CID 113045593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).