methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate

C11H16N4O3 — CID 104925835

IUPACmethyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate
SMILESCCN(C)C(=O)CNc1ccc(C(=O)OC)nn1
InChIInChI=1S/C11H16N4O3/c1-4-15(2)10(16)7-12-9-6-5-8(13-14-9)11(17)18-3/h5-6H,4,7H2,1-3H3,(H,12,14)
InChIKeyMAIPMMDXOYQXBF-UHFFFAOYSA-N
MW252.27 g/mol
LogP0.15
Rot. Bonds5

About methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate

methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate (PubChem CID 104925835) has the molecular formula C11H16N4O3 and a molecular weight of 252.27 g/mol. Its IUPAC name is methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate.

Molecular Properties

Compound Namemethyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate
PubChem CID104925835
Molecular FormulaC11H16N4O3
Molecular Weight252.27 g/mol
Exact Mass252.12
IUPAC Namemethyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate
SMILESCCN(C)C(=O)CNc1ccc(C(=O)OC)nn1
InChIInChI=1S/C11H16N4O3/c1-4-15(2)10(16)7-12-9-6-5-8(13-14-9)11(17)18-3/h5-6H,4,7H2,1-3H3,(H,12,14)
InChIKeyMAIPMMDXOYQXBF-UHFFFAOYSA-N
XLogP0.15
TPSA84.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.27
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 6-[3-(diethylamino)propylamino]pyridazine-3-carboxylate
CID 60792604
methyl 6-(butylamino)pyridazine-3-carboxylate
CID 24820196
methyl 6-[3-(dimethylamino)propylamino]pyridazine-3-carboxylate
CID 60792902
methyl 6-(hexylamino)pyridazine-3-carboxylate
CID 60980718
methyl 6-[(2-methoxy-2-methylpropyl)amino]pyridazine-3-carboxylate
CID 113244113
methyl 6-(prop-2-enylamino)pyridazine-3-carboxylate
CID 60980581
methyl 6-(2,2-dimethoxyethylamino)pyridazine-3-carboxylate
CID 107390127
methyl 6-[2-[cyclopropyl(methyl)amino]ethylamino]pyridazine-3-carboxylate
CID 55142196
methyl 6-[[3-(methylamino)-3-oxopropyl]amino]pyridazine-3-carboxylate
CID 60968294
methyl 6-[(1-methylcyclopropyl)methylamino]pyridazine-3-carboxylate
CID 103724936
methyl 6-[[1-[(dimethylamino)methyl]cyclopentyl]methylamino]pyridazine-3-carboxylate
CID 133491640
methyl 6-(cyclohexylmethylamino)pyridazine-3-carboxylate
CID 54918952

Frequently Asked Questions

What is the IUPAC name of methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate?
The IUPAC name of methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate (CID 104925835) is methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate.
What is the SMILES notation for methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate?
The canonical SMILES for methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate is CCN(C)C(=O)CNc1ccc(C(=O)OC)nn1.
What is the InChIKey of methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate?
The InChIKey is MAIPMMDXOYQXBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O3/c1-4-15(2)10(16)7-12-9-6-5-8(13-14-9)11(17)18-3/h5-6H,4,7H2,1-3H3,(H,12,14).
What are the key properties of methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate?
methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate has a molecular weight of 252.27 g/mol, XLogP of 0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 6-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]pyridazine-3-carboxylate is sourced from PubChem (CID 104925835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).