6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide

C17H22N4O3 — CID 109124457

IUPAC6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
SMILESCCN(CC)C(=O)c1ccc(Nc2cc(OC)ccc2OC)nn1
InChIInChI=1S/C17H22N4O3/c1-5-21(6-2)17(22)13-8-10-16(20-19-13)18-14-11-12(23-3)7-9-15(14)24-4/h7-11H,5-6H2,1-4H3,(H,18,20)
InChIKeyOGKCXZAAPDNVCO-UHFFFAOYSA-N
MW330.39 g/mol
LogP2.72
Rot. Bonds7

About 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide

6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide (PubChem CID 109124457) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
PubChem CID109124457
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC Name6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
SMILESCCN(CC)C(=O)c1ccc(Nc2cc(OC)ccc2OC)nn1
InChIInChI=1S/C17H22N4O3/c1-5-21(6-2)17(22)13-8-10-16(20-19-13)18-14-11-12(23-3)7-9-15(14)24-4/h7-11H,5-6H2,1-4H3,(H,18,20)
InChIKeyOGKCXZAAPDNVCO-UHFFFAOYSA-N
XLogP2.72
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-(2,5-dimethoxyanilino)-N,N-dipropylpyridazine-3-carboxamide
CID 109126252
N-butyl-6-(2,5-dimethoxyanilino)-N-methylpyridazine-3-carboxamide
CID 109125715
N-benzyl-6-(5-chloro-2-methoxyanilino)-N-ethylpyridazine-3-carboxamide
CID 109120619
6-(2,5-dimethoxyanilino)-N-(2-methoxyphenyl)pyridazine-3-carboxamide
CID 109129198
[6-(2,5-dimethoxyanilino)pyridazin-3-yl]-(4-ethylpiperazin-1-yl)methanone
CID 109116727
6-(2,5-dimethoxyanilino)-N-(furan-2-ylmethyl)pyridazine-3-carboxamide
CID 109117625
N-benzyl-6-(2,5-dimethoxyanilino)-N-ethylpyrimidine-4-carboxamide
CID 109349532
N-(2,5-dimethoxyphenyl)-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109129150
6-(2,5-dimethoxyanilino)-N-(3,4-dimethylphenyl)pyridazine-3-carboxamide
CID 109127680
6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
CID 109124452
N-[6-(2,5-dimethoxyanilino)pyridazin-3-yl]-2-(4-methylphenoxy)acetamide
CID 113048769
6-(2,4-dimethoxyanilino)-N-ethyl-N-(3-methylphenyl)pyridazine-3-carboxamide
CID 109129690

Frequently Asked Questions

What is the IUPAC name of 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide?
The IUPAC name of 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide (CID 109124457) is 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide.
What is the SMILES notation for 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide?
The canonical SMILES for 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide is CCN(CC)C(=O)c1ccc(Nc2cc(OC)ccc2OC)nn1.
What is the InChIKey of 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide?
The InChIKey is OGKCXZAAPDNVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-5-21(6-2)17(22)13-8-10-16(20-19-13)18-14-11-12(23-3)7-9-15(14)24-4/h7-11H,5-6H2,1-4H3,(H,18,20).
What are the key properties of 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide?
6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide has a molecular weight of 330.39 g/mol, XLogP of 2.72, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide is sourced from PubChem (CID 109124457), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).