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

C13H14N4O2 — CID 55042566

IUPACN-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)Nc2cccc(OC)c2)nn1
InChIInChI=1S/C13H14N4O2/c1-14-12-7-6-11(16-17-12)13(18)15-9-4-3-5-10(8-9)19-2/h3-8H,1-2H3,(H,14,17)(H,15,18)
InChIKeyMBAZHTVXNXNPON-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.78
Rot. Bonds4

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

N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide (PubChem CID 55042566) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
PubChem CID55042566
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC NameN-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)Nc2cccc(OC)c2)nn1
InChIInChI=1S/C13H14N4O2/c1-14-12-7-6-11(16-17-12)13(18)15-9-4-3-5-10(8-9)19-2/h3-8H,1-2H3,(H,14,17)(H,15,18)
InChIKeyMBAZHTVXNXNPON-UHFFFAOYSA-N
XLogP1.78
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-hydrazinyl-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 55051032
N-(3,5-dimethoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 62173292
N-(3-methoxyphenyl)-6-(3-methylanilino)pyridazine-3-carboxamide
CID 109126899
6-(2,4-dimethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 109129294
N-(3-methoxyphenyl)-6-(4-propan-2-ylanilino)pyridazine-3-carboxamide
CID 109128208
N-(3-methoxyphenyl)-5-(methylamino)pyridine-2-carboxamide
CID 104640036
6-(4-ethoxyanilino)-N-(3-methoxyphenyl)pyridazine-3-carboxamide
CID 109129289
N-(2,4-dimethoxyphenyl)-6-(3-methoxyanilino)pyridazine-3-carboxamide
CID 109129247
2-chloro-N-(3-methoxyphenyl)-6-(methylamino)pyridine-4-carboxamide
CID 62167485
N-(4-bromo-3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide
CID 82860303
N-(3-chlorophenyl)-6-[2-(3-methoxyphenyl)ethylamino]pyridazine-3-carboxamide
CID 109122361
2-N,5-N-bis(3-methoxyphenyl)pyridine-2,5-dicarboxamide
CID 1368781

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide (CID 55042566) is N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide is CNc1ccc(C(=O)Nc2cccc(OC)c2)nn1.
What is the InChIKey of N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide?
The InChIKey is MBAZHTVXNXNPON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-14-12-7-6-11(16-17-12)13(18)15-9-4-3-5-10(8-9)19-2/h3-8H,1-2H3,(H,14,17)(H,15,18).
What are the key properties of N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide?
N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide has a molecular weight of 258.28 g/mol, XLogP of 1.78, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-6-(methylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 55042566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).