6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one

C10H17N3O2 — CID 82442486

IUPAC6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one
SMILESCOCCn1nc(C(C)(C)N)ccc1=O
InChIInChI=1S/C10H17N3O2/c1-10(2,11)8-4-5-9(14)13(12-8)6-7-15-3/h4-5H,6-7,11H2,1-3H3
InChIKeyAHBDTMXTUNSVLZ-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.08
Rot. Bonds4

About 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one

6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one (PubChem CID 82442486) has the molecular formula C10H17N3O2 and a molecular weight of 211.26 g/mol. Its IUPAC name is 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one.

Molecular Properties

Compound Name6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one
PubChem CID82442486
Molecular FormulaC10H17N3O2
Molecular Weight211.26 g/mol
Exact Mass211.13
IUPAC Name6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one
SMILESCOCCn1nc(C(C)(C)N)ccc1=O
InChIInChI=1S/C10H17N3O2/c1-10(2,11)8-4-5-9(14)13(12-8)6-7-15-3/h4-5H,6-7,11H2,1-3H3
InChIKeyAHBDTMXTUNSVLZ-UHFFFAOYSA-N
XLogP0.08
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-methoxyethyl)-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 42443195
1-(2-Methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 43091225
2-(2-Methoxyethyl)-6-methylpyridazin-3-one
CID 90691676
2-(2-Methoxyethyl)-6-propan-2-ylpyridazin-3-one
CID 162773625
1-(2-methoxyethyl)-N-(3-methylbutyl)-6-oxopyridazine-3-carboxamide
CID 30335077
N-butyl-1-(2-methoxyethyl)-6-oxopyridazine-3-carboxamide
CID 30386755
1-(2-methoxyethyl)-6-oxo-N-pentan-3-ylpyridazine-3-carboxamide
CID 30790180
1-(2-methoxyethyl)-N-[(2S)-3-methylbutan-2-yl]-6-oxopyridazine-3-carboxamide
CID 32616714
1-(2-methoxyethyl)-N-[(2R)-3-methylbutan-2-yl]-6-oxopyridazine-3-carboxamide
CID 32616717
N-(2-methoxyethyl)-N-(2-methylpropyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 32953057
N-[(2S)-1-methoxypropan-2-yl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 34832168
N-[(2R)-1-methoxypropan-2-yl]-6-oxo-1-propylpyridazine-3-carboxamide
CID 34832174

Frequently Asked Questions

What is the IUPAC name of 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one?
The IUPAC name of 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one (CID 82442486) is 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one.
What is the SMILES notation for 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one?
The canonical SMILES for 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one is COCCn1nc(C(C)(C)N)ccc1=O.
What is the InChIKey of 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one?
The InChIKey is AHBDTMXTUNSVLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O2/c1-10(2,11)8-4-5-9(14)13(12-8)6-7-15-3/h4-5H,6-7,11H2,1-3H3.
What are the key properties of 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one?
6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one has a molecular weight of 211.26 g/mol, XLogP of 0.08, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminopropan-2-yl)-2-(2-methoxyethyl)pyridazin-3-one is sourced from PubChem (CID 82442486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).