6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide

C11H18N4O2 — CID 113426246

IUPAC6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide
SMILESCC(CO)N(C)c1ccc(C(=O)N(C)C)nn1
InChIInChI=1S/C11H18N4O2/c1-8(7-16)15(4)10-6-5-9(12-13-10)11(17)14(2)3/h5-6,8,16H,7H2,1-4H3
InChIKeyCMGBSDXNEATWEU-UHFFFAOYSA-N
MW238.29 g/mol
LogP-0.00
Rot. Bonds4

About 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide

6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide (PubChem CID 113426246) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide
PubChem CID113426246
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide
SMILESCC(CO)N(C)c1ccc(C(=O)N(C)C)nn1
InChIInChI=1S/C11H18N4O2/c1-8(7-16)15(4)10-6-5-9(12-13-10)11(17)14(2)3/h5-6,8,16H,7H2,1-4H3
InChIKeyCMGBSDXNEATWEU-UHFFFAOYSA-N
XLogP-0.00
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-[Cyclobutyl(methyl)amino]pyridazine-3-carboxamide
CID 75377045
N-cyclohexyl-6-morpholinopyridazine-3-carboxamide
CID 109112982
3-Pyridazinecarboxylic acid, 6-morpholino-, 2-(2-carboxy-1-methylethylidene)hydrazide, ethyl ester
CID 13382920
[6-(Dimethylamino)pyridazin-3-yl]-[4-(piperidine-1-carbonyl)piperazin-1-yl]methanone
CID 53579751
[6-(Dimethylamino)pyridazin-3-yl]-[4-(2-hydroxy-3,3-dimethylbutyl)piperazin-1-yl]methanone
CID 53590130
[4-(2-Hydroxypropyl)piperazin-1-yl]-(6-pyrrolidin-1-ylpyridazin-3-yl)methanone
CID 53625217
[6-(Dimethylamino)pyridazin-3-yl]-[4-(2-hydroxypropyl)piperazin-1-yl]methanone
CID 56802679
[6-(Dimethylamino)pyridazin-3-yl]-[4-(2-hydroxy-2-methylpropyl)piperazin-1-yl]methanone
CID 56803209
[6-(Dimethylamino)pyridazin-3-yl]-[4-(3-ethoxy-2-hydroxypropyl)piperazin-1-yl]methanone
CID 56803211
[6-(Dimethylamino)pyridazin-3-yl]-[4-(2-hydroxybutyl)piperazin-1-yl]methanone
CID 72139701
6-[cyclobutyl(methyl)amino]-N-methylpyridazine-3-carboxamide
CID 75375755
N-methyl-6-(piperazin-1-yl)pyridazine-3-carboxamide dihydrochloride
CID 165943092

Frequently Asked Questions

What is the IUPAC name of 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide?
The IUPAC name of 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide (CID 113426246) is 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide?
The canonical SMILES for 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide is CC(CO)N(C)c1ccc(C(=O)N(C)C)nn1.
What is the InChIKey of 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide?
The InChIKey is CMGBSDXNEATWEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-8(7-16)15(4)10-6-5-9(12-13-10)11(17)14(2)3/h5-6,8,16H,7H2,1-4H3.
What are the key properties of 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide?
6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide has a molecular weight of 238.29 g/mol, XLogP of -0.00, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-hydroxypropan-2-yl(methyl)amino]-N,N-dimethylpyridazine-3-carboxamide is sourced from PubChem (CID 113426246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).