6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide

C18H18N4O4 — CID 109117625

IUPAC6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
SMILESCOc1ccc(OC)c(Nc2ccc(C(=O)NCc3ccco3)nn2)c1
InChIInChI=1S/C18H18N4O4/c1-24-12-5-7-16(25-2)15(10-12)20-17-8-6-14(21-22-17)18(23)19-11-13-4-3-9-26-13/h3-10H,11H2,1-2H3,(H,19,23)(H,20,22)
InChIKeyZGWUPINHWSRUQH-UHFFFAOYSA-N
MW354.37 g/mol
LogP2.76
Rot. Bonds7

About 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide

6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide (PubChem CID 109117625) has the molecular formula C18H18N4O4 and a molecular weight of 354.37 g/mol. Its IUPAC name is 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
PubChem CID109117625
Molecular FormulaC18H18N4O4
Molecular Weight354.37 g/mol
Exact Mass354.13
IUPAC Name6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
SMILESCOc1ccc(OC)c(Nc2ccc(C(=O)NCc3ccco3)nn2)c1
InChIInChI=1S/C18H18N4O4/c1-24-12-5-7-16(25-2)15(10-12)20-17-8-6-14(21-22-17)18(23)19-11-13-4-3-9-26-13/h3-10H,11H2,1-2H3,(H,19,23)(H,20,22)
InChIKeyZGWUPINHWSRUQH-UHFFFAOYSA-N
XLogP2.76
TPSA98.51 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.37
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide
CID 109117456
4-N-(2,5-dimethoxyphenyl)-1-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 109046619
6-(2,5-dimethoxyanilino)-N-(2-methoxyphenyl)pyridazine-3-carboxamide
CID 109129198
N-(furan-2-ylmethyl)-2,4-dimethoxybenzamide
CID 3118683
6-(5-chloro-2-methoxyanilino)-N-(furan-2-ylmethyl)pyrimidine-4-carboxamide
CID 109346394
2-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)acetamide
CID 54814023
N'-(2,5-dimethoxyphenyl)-N-(furan-2-ylmethyl)oxamide
CID 2247281
N-(furan-2-ylmethyl)-6-(2-propan-2-ylanilino)pyridazine-3-carboxamide
CID 109117595
5-(2,5-dimethoxyphenyl)-N-(furan-2-ylmethyl)-1,2-oxazole-3-carboxamide
CID 3235828
6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
CID 109124457
N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109129150
2-(2,4-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridine-4-carboxamide
CID 109169277

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide (CID 109117625) is 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide is COc1ccc(OC)c(Nc2ccc(C(=O)NCc3ccco3)nn2)c1.
What is the InChIKey of 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide?
The InChIKey is ZGWUPINHWSRUQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4/c1-24-12-5-7-16(25-2)15(10-12)20-17-8-6-14(21-22-17)18(23)19-11-13-4-3-9-26-13/h3-10H,11H2,1-2H3,(H,19,23)(H,20,22).
What are the key properties of 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide?
6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide has a molecular weight of 354.37 g/mol, XLogP of 2.76, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109117625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).