N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide

C18H18N4O4 — CID 109117456

IUPACN-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(NCc3ccco3)nn2)c1
InChIInChI=1S/C18H18N4O4/c1-24-12-5-7-16(25-2)15(10-12)20-18(23)14-6-8-17(22-21-14)19-11-13-4-3-9-26-13/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyNXLNWARHUMNHIQ-UHFFFAOYSA-N
MW354.37 g/mol
LogP2.95
Rot. Bonds7

About N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide

N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide (PubChem CID 109117456) has the molecular formula C18H18N4O4 and a molecular weight of 354.37 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide
PubChem CID109117456
Molecular FormulaC18H18N4O4
Molecular Weight354.37 g/mol
Exact Mass354.13
IUPAC NameN-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2ccc(NCc3ccco3)nn2)c1
InChIInChI=1S/C18H18N4O4/c1-24-12-5-7-16(25-2)15(10-12)20-18(23)14-6-8-17(22-21-14)19-11-13-4-3-9-26-13/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23)
InChIKeyNXLNWARHUMNHIQ-UHFFFAOYSA-N
XLogP2.95
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 ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

6-(furan-2-ylmethylamino)-N-(4-methoxyphenyl)pyridazine-3-carboxamide
CID 109117450
6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 109117625
6-[(2-chlorophenyl)methylamino]-N-(2,5-dimethoxyphenyl)pyridazine-3-carboxamide
CID 109119698
4-N-(2,5-dimethoxyphenyl)-1-N-(furan-2-ylmethyl)benzene-1,4-dicarboxamide
CID 109046619
N-(2,5-dimethoxyphenyl)-6-methoxypyridazine-3-carboxamide
CID 90509292
N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109129150
N-(2-methoxy-5-methylphenyl)-6-[(4-methoxyphenyl)methylamino]pyridazine-3-carboxamide
CID 109120227
N-(2,5-dimethoxyphenyl)-6-[2-(2-fluorophenyl)ethylamino]pyridazine-3-carboxamide
CID 109121963
N'-(2,5-dimethoxyphenyl)-N-(furan-2-ylmethyl)oxamide
CID 2247281
5-(furan-2-ylmethylamino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109187758
N-[6-(furan-2-ylmethylamino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113040667
6-(2,5-dimethoxyanilino)-N-(2-methoxyphenyl)pyridazine-3-carboxamide
CID 109129198

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide (CID 109117456) is N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide is COc1ccc(OC)c(NC(=O)c2ccc(NCc3ccco3)nn2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide?
The InChIKey is NXLNWARHUMNHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4/c1-24-12-5-7-16(25-2)15(10-12)20-18(23)14-6-8-17(22-21-14)19-11-13-4-3-9-26-13/h3-10H,11H2,1-2H3,(H,19,22)(H,20,23).
What are the key properties of N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide?
N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide has a molecular weight of 354.37 g/mol, XLogP of 2.95, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-6-(furan-2-ylmethylamino)pyridazine-3-carboxamide is sourced from PubChem (CID 109117456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).