2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide

C10H16N4O3 — CID 103222747

IUPAC2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide
SMILESCCNC(=O)Cn1ncc(OCCN)cc1=O
InChIInChI=1S/C10H16N4O3/c1-2-12-9(15)7-14-10(16)5-8(6-13-14)17-4-3-11/h5-6H,2-4,7,11H2,1H3,(H,12,15)
InChIKeyHXVDOVCZRRVKKM-UHFFFAOYSA-N
MW240.26 g/mol
LogP-1.28
Rot. Bonds6

About 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide

2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide (PubChem CID 103222747) has the molecular formula C10H16N4O3 and a molecular weight of 240.26 g/mol. Its IUPAC name is 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide.

Molecular Properties

Compound Name2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide
PubChem CID103222747
Molecular FormulaC10H16N4O3
Molecular Weight240.26 g/mol
Exact Mass240.12
IUPAC Name2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide
SMILESCCNC(=O)Cn1ncc(OCCN)cc1=O
InChIInChI=1S/C10H16N4O3/c1-2-12-9(15)7-14-10(16)5-8(6-13-14)17-4-3-11/h5-6H,2-4,7,11H2,1H3,(H,12,15)
InChIKeyHXVDOVCZRRVKKM-UHFFFAOYSA-N
XLogP-1.28
TPSA99.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 5-1.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103222825
2-[4-(2-aminopropoxy)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103223046
2-[4-(3-aminopropoxy)-6-oxopyridazin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 103223254
2-[2-(2-Ethoxyethylamino)ethyl]pyridazin-3-one
CID 62850693
5-(2-Aminoethoxy)-2-methylpyridazin-3-one
CID 84075911
2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(2-methoxyethyl)acetamide
CID 103219068
2-[4-(2-aminoethylamino)-6-oxopyridazin-1-yl]-N-(2-methoxyethyl)acetamide
CID 103221187
5-(2-Aminoethoxy)-2-hexylpyridazin-3-one
CID 103222645
5-(2-Aminoethoxy)-2-(2-methylpropyl)pyridazin-3-one
CID 103222646
2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N,N-diethylacetamide
CID 103222647
2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-(2-cyanoethyl)acetamide
CID 103222649
2-[4-(2-Aminoethoxy)-6-oxopyridazin-1-yl]acetonitrile
CID 103222651

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide?
The IUPAC name of 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide (CID 103222747) is 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide.
What is the SMILES notation for 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide?
The canonical SMILES for 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide is CCNC(=O)Cn1ncc(OCCN)cc1=O.
What is the InChIKey of 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide?
The InChIKey is HXVDOVCZRRVKKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O3/c1-2-12-9(15)7-14-10(16)5-8(6-13-14)17-4-3-11/h5-6H,2-4,7,11H2,1H3,(H,12,15).
What are the key properties of 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide?
2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide has a molecular weight of 240.26 g/mol, XLogP of -1.28, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminoethoxy)-6-oxopyridazin-1-yl]-N-ethylacetamide is sourced from PubChem (CID 103222747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).