2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide

C9H14N4O2 — CID 103218215

IUPAC2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide
SMILESCCCNC(=O)Cn1ncc(N)cc1=O
InChIInChI=1S/C9H14N4O2/c1-2-3-11-8(14)6-13-9(15)4-7(10)5-12-13/h4-5H,2-3,6,10H2,1H3,(H,11,14)
InChIKeyZCDUUIHRAXVTLL-UHFFFAOYSA-N
MW210.24 g/mol
LogP-0.65
Rot. Bonds4

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

2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide (PubChem CID 103218215) 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-propylacetamide.

Molecular Properties

Compound Name2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide
PubChem CID103218215
Molecular FormulaC9H14N4O2
Molecular Weight210.24 g/mol
Exact Mass210.11
IUPAC Name2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide
SMILESCCCNC(=O)Cn1ncc(N)cc1=O
InChIInChI=1S/C9H14N4O2/c1-2-3-11-8(14)6-13-9(15)4-7(10)5-12-13/h4-5H,2-3,6,10H2,1H3,(H,11,14)
InChIKeyZCDUUIHRAXVTLL-UHFFFAOYSA-N
XLogP-0.65
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 5-0.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(Dimethylamino)-N-[1-(1-ethyl-6-oxo-1,6-dihydropyridazin-4-YL)piperidin-4-YL]acetamide
CID 91924057
N~2~-methyl-N~1~-{[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-3-pyrrolidinyl]methyl}glycinamide
CID 70761816
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-[4-(cyclopropylamino)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103219931
2-[6-oxo-4-(propylamino)pyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103220293
2-[4-(cyclobutylamino)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103220641

Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide?
The IUPAC name of 2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide (CID 103218215) is 2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide.
What is the SMILES notation for 2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide?
The canonical SMILES for 2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide is CCCNC(=O)Cn1ncc(N)cc1=O.
What is the InChIKey of 2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide?
The InChIKey is ZCDUUIHRAXVTLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N4O2/c1-2-3-11-8(14)6-13-9(15)4-7(10)5-12-13/h4-5H,2-3,6,10H2,1H3,(H,11,14).
What are the key properties of 2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide?
2-(4-amino-6-oxopyridazin-1-yl)-N-propylacetamide has a molecular weight of 210.24 g/mol, XLogP of -0.65, 4 rotatable bonds, 2 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-propylacetamide is sourced from PubChem (CID 103218215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).