2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide

C13H14N4O2 — CID 144928471

IUPAC2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide
SMILESCCOc1ccc(CC(=O)Nc2cccnn2)nc1
InChIInChI=1S/C13H14N4O2/c1-2-19-11-6-5-10(14-9-11)8-13(18)16-12-4-3-7-15-17-12/h3-7,9H,2,8H2,1H3,(H,16,17,18)
InChIKeyZVXHECSVZZVYGX-UHFFFAOYSA-N
MW258.28 g/mol
LogP1.45
Rot. Bonds5

About 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide

2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide (PubChem CID 144928471) has the molecular formula C13H14N4O2 and a molecular weight of 258.28 g/mol. Its IUPAC name is 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide.

Molecular Properties

Compound Name2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide
PubChem CID144928471
Molecular FormulaC13H14N4O2
Molecular Weight258.28 g/mol
Exact Mass258.11
IUPAC Name2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide
SMILESCCOc1ccc(CC(=O)Nc2cccnn2)nc1
InChIInChI=1S/C13H14N4O2/c1-2-19-11-6-5-10(14-9-11)8-13(18)16-12-4-3-7-15-17-12/h3-7,9H,2,8H2,1H3,(H,16,17,18)
InChIKeyZVXHECSVZZVYGX-UHFFFAOYSA-N
XLogP1.45
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.28
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(5-ethoxy-2-pyridinyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)acetamide
CID 144630841
N-(4-ethoxyphenyl)-2-pyridin-2-ylacetamide
CID 110696990
2-(4-ethoxyphenyl)-N-pyridin-2-ylacetamide
CID 17458735
2-methyl-N-pyridazin-3-ylpropanamide
CID 126995895
N-[(5-ethoxy-2-pyridinyl)methyl]ethanamine
CID 79775704
2-(4-ethoxyphenyl)-N-(3-hydroxy-2-pyridinyl)acetamide
CID 18109298
pyridazin-3-ylurea
CID 13080987
2-(4-carbamothioylphenyl)-N-pyridazin-3-ylacetamide
CID 116787129
1-(5-ethoxy-2-pyridinyl)-3-[6-[(1S,3S)-3-[6-[3-(5-ethoxy-2-pyridinyl)-2-oxopropyl]pyridazin-3-yl]cyclohexyl]pyridazin-3-yl]propan-2-one
CID 158025034
2-anilino-N-pyridazin-3-ylacetamide
CID 116786848
5-ethoxy-2-methylpyridine
CID 573198
2-(2-anilino-1,3-thiazol-4-yl)-N-(4-ethoxyphenyl)acetamide
CID 27377773

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide?
The IUPAC name of 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide (CID 144928471) is 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide.
What is the SMILES notation for 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide?
The canonical SMILES for 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide is CCOc1ccc(CC(=O)Nc2cccnn2)nc1.
What is the InChIKey of 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide?
The InChIKey is ZVXHECSVZZVYGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N4O2/c1-2-19-11-6-5-10(14-9-11)8-13(18)16-12-4-3-7-15-17-12/h3-7,9H,2,8H2,1H3,(H,16,17,18).
What are the key properties of 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide?
2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide has a molecular weight of 258.28 g/mol, XLogP of 1.45, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethoxy-2-pyridinyl)-N-pyridazin-3-ylacetamide is sourced from PubChem (CID 144928471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).