N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide

C19H18N4O2 — CID 109126899

IUPACN-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(Nc3cccc(C)c3)nn2)c1
InChIInChI=1S/C19H18N4O2/c1-13-5-3-6-14(11-13)20-18-10-9-17(22-23-18)19(24)21-15-7-4-8-16(12-15)25-2/h3-12H,1-2H3,(H,20,23)(H,21,24)
InChIKeyZVSPOIKYLFAVNT-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.79
Rot. Bonds5

About N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide

N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide (PubChem CID 109126899) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide
PubChem CID109126899
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide
SMILESCOc1cccc(NC(=O)c2ccc(Nc3cccc(C)c3)nn2)c1
InChIInChI=1S/C19H18N4O2/c1-13-5-3-6-14(11-13)20-18-10-9-17(22-23-18)19(24)21-15-7-4-8-16(12-15)25-2/h3-12H,1-2H3,(H,20,23)(H,21,24)
InChIKeyZVSPOIKYLFAVNT-UHFFFAOYSA-N
XLogP3.79
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(3-methylanilino)-N-phenylpyridazine-3-carboxamide
CID 109126645
6-(3-bromoanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide
CID 109126993
6-(4-methylanilino)-N-(3-methylphenyl)pyridazine-3-carboxamide
CID 109126943
N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 55042566
N-(3-methoxyphenyl)-6-(4-propan-2-ylanilino)pyridazine-3-carboxamide
CID 109128208
6-hydrazinyl-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 55051032
6-(4-ethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 109129289
N-(4-bromophenyl)-6-(3-methylanilino)pyridazine-3-carboxamide
CID 109126897
6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 109129294
N-(2,4-dimethoxyphenyl)-6-(3-methoxyanilino)pyridazine-3-carboxamide
CID 109129247
N-(2,5-dichlorophenyl)-6-(3-methoxyanilino)pyridazine-3-carboxamide
CID 109129273
N-(3-methoxyphenyl)-3-[[6-(3-methylphenyl)pyridazin-3-yl]amino]benzamide
CID 46322365

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide (CID 109126899) is N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide is COc1cccc(NC(=O)c2ccc(Nc3cccc(C)c3)nn2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide?
The InChIKey is ZVSPOIKYLFAVNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-13-5-3-6-14(11-13)20-18-10-9-17(22-23-18)19(24)21-15-7-4-8-16(12-15)25-2/h3-12H,1-2H3,(H,20,23)(H,21,24).
What are the key properties of N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide?
N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide is sourced from PubChem (CID 109126899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).