N-ethyl-2-(6-oxopyridazin-1-yl)acetamide

C8H11N3O2 — CID 131201227

IUPACN-ethyl-2-(6-oxopyridazin-1-yl)acetamide
SMILESCCNC(=O)Cn1ncccc1=O
InChIInChI=1S/C8H11N3O2/c1-2-9-7(12)6-11-8(13)4-3-5-10-11/h3-5H,2,6H2,1H3,(H,9,12)
InChIKeyUKBDOASTVWHLEH-UHFFFAOYSA-N
MW181.20 g/mol
LogP-0.62
Rot. Bonds3

About N-ethyl-2-(6-oxopyridazin-1-yl)acetamide

N-ethyl-2-(6-oxopyridazin-1-yl)acetamide (PubChem CID 131201227) has the molecular formula C8H11N3O2 and a molecular weight of 181.20 g/mol. Its IUPAC name is N-ethyl-2-(6-oxopyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(6-oxopyridazin-1-yl)acetamide
PubChem CID131201227
Molecular FormulaC8H11N3O2
Molecular Weight181.20 g/mol
Exact Mass181.09
IUPAC NameN-ethyl-2-(6-oxopyridazin-1-yl)acetamide
SMILESCCNC(=O)Cn1ncccc1=O
InChIInChI=1S/C8H11N3O2/c1-2-9-7(12)6-11-8(13)4-3-5-10-11/h3-5H,2,6H2,1H3,(H,9,12)
InChIKeyUKBDOASTVWHLEH-UHFFFAOYSA-N
XLogP-0.62
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-Aminoethyl)-2,3-dihydropyridazin-3-one
CID 10534729
(6-Oxopyridazin-1-yl)acetamide
CID 62848563
2-[2-(2,2,2-Trifluoroethylamino)ethyl]pyridazin-3-one
CID 62851211
5-Acetylamino-1-methyl-6-pyridazone
CID 14626616
N-(2-methyl-3-oxopyridazin-4-yl)propanamide
CID 14626617
N-methyl-3-(3-oxo-2-pyridazinyl)propionamide
CID 20300060
2-(2-(Dimethylamino)ethyl)pyridazin-3(2H)-one
CID 25181395
N-isopropyl-2-(6-oxopyridazin-1(6H)-yl)acetamide
CID 45548738
2-(6-Oxopyridazin-1-yl)acetohydrazide
CID 63579057
N-methyl-4-(6-oxopyridazin-1-yl)butanamide
CID 88975423
N,N-dimethyl-2-(6-oxopyridazin-1-yl)acetamide
CID 130638489
N-methyl-2-(6-oxopyridazin-1-yl)acetamide
CID 130682875

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(6-oxopyridazin-1-yl)acetamide?
The IUPAC name of N-ethyl-2-(6-oxopyridazin-1-yl)acetamide (CID 131201227) is N-ethyl-2-(6-oxopyridazin-1-yl)acetamide.
What is the SMILES notation for N-ethyl-2-(6-oxopyridazin-1-yl)acetamide?
The canonical SMILES for N-ethyl-2-(6-oxopyridazin-1-yl)acetamide is CCNC(=O)Cn1ncccc1=O.
What is the InChIKey of N-ethyl-2-(6-oxopyridazin-1-yl)acetamide?
The InChIKey is UKBDOASTVWHLEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c1-2-9-7(12)6-11-8(13)4-3-5-10-11/h3-5H,2,6H2,1H3,(H,9,12).
What are the key properties of N-ethyl-2-(6-oxopyridazin-1-yl)acetamide?
N-ethyl-2-(6-oxopyridazin-1-yl)acetamide has a molecular weight of 181.20 g/mol, XLogP of -0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(6-oxopyridazin-1-yl)acetamide is sourced from PubChem (CID 131201227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).