N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide

C9H13N3O3 — CID 60652659

IUPACN-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide
SMILESCN(CCO)C(=O)c1ccc(=O)n(C)n1
InChIInChI=1S/C9H13N3O3/c1-11(5-6-13)9(15)7-3-4-8(14)12(2)10-7/h3-4,13H,5-6H2,1-2H3
InChIKeyINGOTVKNXAZGAV-UHFFFAOYSA-N
MW211.22 g/mol
LogP-1.16
Rot. Bonds3

About N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide

N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide (PubChem CID 60652659) has the molecular formula C9H13N3O3 and a molecular weight of 211.22 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide
PubChem CID60652659
Molecular FormulaC9H13N3O3
Molecular Weight211.22 g/mol
Exact Mass211.10
IUPAC NameN-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide
SMILESCN(CCO)C(=O)c1ccc(=O)n(C)n1
InChIInChI=1S/C9H13N3O3/c1-11(5-6-13)9(15)7-3-4-8(14)12(2)10-7/h3-4,13H,5-6H2,1-2H3
InChIKeyINGOTVKNXAZGAV-UHFFFAOYSA-N
XLogP-1.16
TPSA75.43 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 5-1.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,1-dimethyl-N-[2-(2-methylphenoxy)ethyl]-6-oxopyridazine-3-carboxamide
CID 51241769
N-butyl-N-ethyl-1-methyl-6-oxopyridazine-3-carboxamide
CID 78785110
N,1-dimethyl-N-[(3-methylthiophen-2-yl)methyl]-6-oxopyridazine-3-carboxamide
CID 29049954
N-(2,3-dihydroxypropyl)-1-methyl-6-oxopyridazine-3-carboxamide
CID 66176866
2-[ethyl-(1-methyl-6-oxopyridazine-3-carbonyl)amino]acetic acid
CID 54901036
N-(4-hydroxybutan-2-yl)-1-methyl-6-oxopyridazine-3-carboxamide
CID 81041108
N-[3-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]propyl]-N,1-dimethyl-6-oxopyridazine-3-carboxamide
CID 55867788
4-[(1-methyl-6-oxopyridazine-3-carbonyl)amino]butanoic acid
CID 43091994
1-methyl-6-oxo-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 42161813
N-[2-(dimethylamino)-2-(4-methylphenyl)ethyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 47082065
1-(cyclopropylmethyl)-N-(2-hydroxyethyl)-N-methylpyrazole-3-carboxamide
CID 134394459
N-benzyl-1-methyl-6-oxo-N-phenylpyridazine-3-carboxamide
CID 42161824

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide (CID 60652659) is N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide is CN(CCO)C(=O)c1ccc(=O)n(C)n1.
What is the InChIKey of N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide?
The InChIKey is INGOTVKNXAZGAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O3/c1-11(5-6-13)9(15)7-3-4-8(14)12(2)10-7/h3-4,13H,5-6H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide?
N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide has a molecular weight of 211.22 g/mol, XLogP of -1.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N,1-dimethyl-6-oxopyridazine-3-carboxamide is sourced from PubChem (CID 60652659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).