6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide

C17H22N4O2 — CID 109124452

IUPAC6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)N(CC)CC)nn1
InChIInChI=1S/C17H22N4O2/c1-4-21(5-2)17(22)14-11-12-16(20-19-14)18-13-9-7-8-10-15(13)23-6-3/h7-12H,4-6H2,1-3H3,(H,18,20)
InChIKeyDOPISLZPOWSKGL-UHFFFAOYSA-N
MW314.39 g/mol
LogP3.10
Rot. Bonds7

About 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide

6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide (PubChem CID 109124452) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
PubChem CID109124452
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC Name6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
SMILESCCOc1ccccc1Nc1ccc(C(=O)N(CC)CC)nn1
InChIInChI=1S/C17H22N4O2/c1-4-21(5-2)17(22)14-11-12-16(20-19-14)18-13-9-7-8-10-15(13)23-6-3/h7-12H,4-6H2,1-3H3,(H,18,20)
InChIKeyDOPISLZPOWSKGL-UHFFFAOYSA-N
XLogP3.10
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-ethoxyanilino)-N,N-diethylpyrazine-2-carboxamide
CID 109286788
N,N-diethyl-6-(2-fluoroanilino)pyridazine-3-carboxamide
CID 109124434
6-(2-ethoxyanilino)-N-(3-methoxypropyl)pyridazine-3-carboxamide
CID 109114381
N,N-diethyl-6-[2-(trifluoromethyl)anilino]pyridazine-3-carboxamide
CID 109124460
2-(2-ethoxyanilino)-N,N-diethylpyridine-4-carboxamide
CID 109174723
6-(2-ethoxyanilino)-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109127101
N-(2-ethoxyphenyl)-6-(2-ethylanilino)pyridazine-3-carboxamide
CID 109127901
6-(2-ethoxyanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridazine-3-carboxamide
CID 109122308
6-(3-chloro-2-methylanilino)-N,N-diethylpyridazine-3-carboxamide
CID 109124439
6-(2,5-dimethoxyanilino)-N,N-diethylpyridazine-3-carboxamide
CID 109124457
N-(3,4-difluorophenyl)-6-(2-ethoxyanilino)pyridazine-3-carboxamide
CID 109129455
[6-(2-ethoxyanilino)pyridazin-3-yl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109129448

Frequently Asked Questions

What is the IUPAC name of 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide?
The IUPAC name of 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide (CID 109124452) is 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide.
What is the SMILES notation for 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide?
The canonical SMILES for 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide is CCOc1ccccc1Nc1ccc(C(=O)N(CC)CC)nn1.
What is the InChIKey of 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide?
The InChIKey is DOPISLZPOWSKGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-4-21(5-2)17(22)14-11-12-16(20-19-14)18-13-9-7-8-10-15(13)23-6-3/h7-12H,4-6H2,1-3H3,(H,18,20).
What are the key properties of 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide?
6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide has a molecular weight of 314.39 g/mol, XLogP of 3.10, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethoxyanilino)-N,N-diethylpyridazine-3-carboxamide is sourced from PubChem (CID 109124452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).