N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide

C12H19N3O3 — CID 32953057

IUPACN-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1ccc(=O)[nH]n1
InChIInChI=1S/C12H19N3O3/c1-9(2)8-15(6-7-18-3)12(17)10-4-5-11(16)14-13-10/h4-5,9H,6-8H2,1-3H3,(H,14,16)
InChIKeyHDZRXCRWPQDZTK-UHFFFAOYSA-N
MW253.30 g/mol
LogP0.51
Rot. Bonds6

About N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide

N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide (PubChem CID 32953057) has the molecular formula C12H19N3O3 and a molecular weight of 253.30 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide
PubChem CID32953057
Molecular FormulaC12H19N3O3
Molecular Weight253.30 g/mol
Exact Mass253.14
IUPAC NameN-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide
SMILESCOCCN(CC(C)C)C(=O)c1ccc(=O)[nH]n1
InChIInChI=1S/C12H19N3O3/c1-9(2)8-15(6-7-18-3)12(17)10-4-5-11(16)14-13-10/h4-5,9H,6-8H2,1-3H3,(H,14,16)
InChIKeyHDZRXCRWPQDZTK-UHFFFAOYSA-N
XLogP0.51
TPSA75.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-methoxyethyl)-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 42443195
N-[(2S)-3-methylbutan-2-yl]-6-oxo-N-prop-2-enyl-1H-pyridazine-3-carboxamide
CID 40151649
N,N-diethyl-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 45797767
1-(2-methoxyethyl)-N-[3-[methyl(2,2,2-trifluoroethyl)amino]propyl]-6-oxopyridazine-3-carboxamide
CID 45893404
N-(3-methylbutan-2-yl)-6-oxo-N-prop-2-enyl-1H-pyridazine-3-carboxamide
CID 42959606
N-ethyl-N-(1-ethylpropyl)-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 56721184
6-(morpholine-4-carbonyl)pyridazin-3(2H)-one
CID 948188
1-(2-Methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 43091225
N,N-bis(3-methylbutyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 70971865
2-methyl-N-[(6-oxo-1H-pyridazin-3-yl)methyl]propanamide
CID 133618153
2-(2-Methoxyethyl)-6-propan-2-ylpyridazin-3-one
CID 162773625
N-[(2S)-1-methoxypropan-2-yl]-3-methyl-6-oxo-1H-pyridazine-5-carboxamide
CID 167518055

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide (CID 32953057) is N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide is COCCN(CC(C)C)C(=O)c1ccc(=O)[nH]n1.
What is the InChIKey of N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide?
The InChIKey is HDZRXCRWPQDZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O3/c1-9(2)8-15(6-7-18-3)12(17)10-4-5-11(16)14-13-10/h4-5,9H,6-8H2,1-3H3,(H,14,16).
What are the key properties of N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide?
N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide has a molecular weight of 253.30 g/mol, XLogP of 0.51, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 32953057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).