2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide

C9H14N4O2 — CID 103218180

IUPAC2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)Cn1ncc(N)cc1=O
InChIInChI=1S/C9H14N4O2/c1-3-12(2)9(15)6-13-8(14)4-7(10)5-11-13/h4-5H,3,6,10H2,1-2H3
InChIKeyPVNYTFPMJMEDHA-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.70
Rot. Bonds3

About 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide

2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide (PubChem CID 103218180) has the molecular formula C9H14N4O2 and a molecular weight of 210.24 g/mol. Its IUPAC name is 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide.

Molecular Properties

Compound Name2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide
PubChem CID103218180
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide
SMILESCCN(C)C(=O)Cn1ncc(N)cc1=O
InChIInChI=1S/C9H14N4O2/c1-3-12(2)9(15)6-13-8(14)4-7(10)5-11-13/h4-5H,3,6,10H2,1-2H3
InChIKeyPVNYTFPMJMEDHA-UHFFFAOYSA-N
XLogP-0.70
TPSA81.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[4-(4-methyl-1-piperazinyl)-6-oxo-1(6H)-pyridazinyl]propanamide
CID 56910372
2-[4-(dimethylamino)-6-oxopyridazin-1(6H)-yl]-N-(1,1-dimethylpropyl)acetamide
CID 72901531
2-(4-amino-6-oxopyridazin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 176088765
(2R)-2-(4-amino-6-oxopyridazin-1-yl)-N-methyl-N-(2,2,2-trifluoroethyl)propanamide
CID 176088829
2-(4-amino-6-oxopyridazin-1-yl)-N-(2,2,2-trifluoroethyl)acetamide
CID 103218361
2-[4-(methylamino)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103218675
2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103219116
2-[6-oxo-4-(propan-2-ylamino)pyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103219530
2-[6-oxo-4-(propylamino)pyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103220293
2-[4-(2-aminoethylamino)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103221221
2-[4-[2-aminoethyl(methyl)amino]-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103223469
2-[4-[2-(methylamino)ethylamino]-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103223681

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide?
The IUPAC name of 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide (CID 103218180) is 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide.
What is the SMILES notation for 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide?
The canonical SMILES for 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide is CCN(C)C(=O)Cn1ncc(N)cc1=O.
What is the InChIKey of 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide?
The InChIKey is PVNYTFPMJMEDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-3-12(2)9(15)6-13-8(14)4-7(10)5-11-13/h4-5H,3,6,10H2,1-2H3.
What are the key properties of 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide?
2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide has a molecular weight of 210.24 g/mol, XLogP of -0.70, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-6-oxopyridazin-1-yl)-N-ethyl-N-methylacetamide is sourced from PubChem (CID 103218180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).