2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide

C14H16N4O3 — CID 42142535

IUPAC2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide
SMILESCOCC(=O)NCCn1nc(-c2cccnc2)ccc1=O
InChIInChI=1S/C14H16N4O3/c1-21-10-13(19)16-7-8-18-14(20)5-4-12(17-18)11-3-2-6-15-9-11/h2-6,9H,7-8,10H2,1H3,(H,16,19)
InChIKeyMAMWAUKKRNOMOQ-UHFFFAOYSA-N
MW288.31 g/mol
LogP0.07
Rot. Bonds6

About 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide

2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide (PubChem CID 42142535) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide.

Molecular Properties

Compound Name2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide
PubChem CID42142535
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC Name2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide
SMILESCOCC(=O)NCCn1nc(-c2cccnc2)ccc1=O
InChIInChI=1S/C14H16N4O3/c1-21-10-13(19)16-7-8-18-14(20)5-4-12(17-18)11-3-2-6-15-9-11/h2-6,9H,7-8,10H2,1H3,(H,16,19)
InChIKeyMAMWAUKKRNOMOQ-UHFFFAOYSA-N
XLogP0.07
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3,3-diphenylpropyl)-2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)acetamide
CID 121052463
N-[2-(4-ethoxyphenoxy)ethyl]-2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)acetamide
CID 121052481
2,3-dimethoxy-N-[3-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)propyl]benzamide
CID 42143602
2-(2-aminoethyl)-6-pyridin-3-ylpyridazin-3-one
CID 52903522
2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]acetamide
CID 121050358
2-[2-(dimethylamino)ethyl]-6-pyridin-3-ylpyridazin-3-one
CID 147180179
2-(4-acetylphenoxy)-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]acetamide
CID 121033289
2-(3-methyl-6-oxopyridazin-1-yl)-N-[2-(6-oxo-3-phenylpyridazin-1-yl)ethyl]acetamide
CID 121033306
3-(4-methoxyphenyl)-N-[2-[3-(4-methoxyphenyl)-6-oxopyridazin-1-yl]ethyl]propanamide
CID 41240937
N-[2-[5-(3-methoxyphenyl)-3-pyridin-3-ylpyrazol-1-yl]ethyl]-2-(4-oxo-1,3-thiazolidin-3-yl)acetamide
CID 92600380
methyl 3-[(6-oxo-3-pyridin-3-ylpyridazin-1-yl)methyl]benzoate
CID 90332934
N-[2-oxo-2-[2-(6-oxo-3-phenylpyridazin-1-yl)ethylamino]ethyl]benzamide
CID 121033287

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide?
The IUPAC name of 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide (CID 42142535) is 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide.
What is the SMILES notation for 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide?
The canonical SMILES for 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide is COCC(=O)NCCn1nc(-c2cccnc2)ccc1=O.
What is the InChIKey of 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide?
The InChIKey is MAMWAUKKRNOMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c1-21-10-13(19)16-7-8-18-14(20)5-4-12(17-18)11-3-2-6-15-9-11/h2-6,9H,7-8,10H2,1H3,(H,16,19).
What are the key properties of 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide?
2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide has a molecular weight of 288.31 g/mol, XLogP of 0.07, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)ethyl]acetamide is sourced from PubChem (CID 42142535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).