2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide

C10H14N4O2 — CID 116788314

IUPAC2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide
SMILESCN(C(=O)Cn1nc(N)ccc1=O)C1CC1
InChIInChI=1S/C10H14N4O2/c1-13(7-2-3-7)10(16)6-14-9(15)5-4-8(11)12-14/h4-5,7H,2-3,6H2,1H3,(H2,11,12)
InChIKeyROCUXOYHIYXRND-UHFFFAOYSA-N
MW222.25 g/mol
LogP-0.55
Rot. Bonds3

About 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide

2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide (PubChem CID 116788314) has the molecular formula C10H14N4O2 and a molecular weight of 222.25 g/mol. Its IUPAC name is 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide.

Molecular Properties

Compound Name2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide
PubChem CID116788314
Molecular FormulaC10H14N4O2
Molecular Weight222.25 g/mol
Exact Mass222.11
IUPAC Name2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide
SMILESCN(C(=O)Cn1nc(N)ccc1=O)C1CC1
InChIInChI=1S/C10H14N4O2/c1-13(7-2-3-7)10(16)6-14-9(15)5-4-8(11)12-14/h4-5,7H,2-3,6H2,1H3,(H2,11,12)
InChIKeyROCUXOYHIYXRND-UHFFFAOYSA-N
XLogP-0.55
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.25
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide 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

6-Amino-2-[2-(dimethylamino)ethyl]pyridazin-3-one
CID 116788154
6-amino-2-[(2S)-butan-2-yl]pyridazin-3-one
CID 163438899
6-amino-2-[(2R)-butan-2-yl]pyridazin-3-one
CID 163438900
6-Amino-2-butan-2-ylpyridazin-3-one
CID 165381257
6-amino-2-[(2R)-butan-2-yl]pyridazin-3-one;6-amino-2-butan-2-ylpyridazin-3-one
CID 166653549
6-Amino-2-butan-2-ylpyridazin-3-one
CID 166653550
6-Amino-2-butan-2-ylpyridazin-3-one;hydrochloride
CID 166653623
6-amino-2-[(2R)-butan-2-yl]pyridazin-3-one;6-amino-2-[(2S)-butan-2-yl]pyridazin-3-one
CID 167580727
6-amino-2-[(2R)-butan-2-yl]pyridazin-3-one;6-amino-2-[(2S)-butan-2-yl]pyridazin-3-one;methane
CID 167626900
2-(3-Amino-6-oxopyridazin-1-yl)ethyl-dimethylazanium
CID 168824389
N-(6-amino-2-methyl-3-oxopyridazin-4-yl)prop-2-enamide
CID 170969724
2-(3-amino-6-oxopyridazin-1-yl)-N-(2-methylbutan-2-yl)acetamide
CID 113564083

Frequently Asked Questions

What is the IUPAC name of 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide?
The IUPAC name of 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide (CID 116788314) is 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide.
What is the SMILES notation for 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide?
The canonical SMILES for 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide is CN(C(=O)Cn1nc(N)ccc1=O)C1CC1.
What is the InChIKey of 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide?
The InChIKey is ROCUXOYHIYXRND-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O2/c1-13(7-2-3-7)10(16)6-14-9(15)5-4-8(11)12-14/h4-5,7H,2-3,6H2,1H3,(H2,11,12).
What are the key properties of 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide?
2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide has a molecular weight of 222.25 g/mol, XLogP of -0.55, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-amino-6-oxopyridazin-1-yl)-N-cyclopropyl-N-methylacetamide is sourced from PubChem (CID 116788314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).