N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide

C21H21N3O3 — CID 43991013

IUPACN-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide
SMILESCCOc1ccc(-c2ccc(NC(=O)COc3ccc(C)cc3)cc2)nn1
InChIInChI=1S/C21H21N3O3/c1-3-26-21-13-12-19(23-24-21)16-6-8-17(9-7-16)22-20(25)14-27-18-10-4-15(2)5-11-18/h4-13H,3,14H2,1-2H3,(H,22,25)
InChIKeyYMZHWCCVADTYSC-UHFFFAOYSA-N
MW363.42 g/mol
LogP3.87
Rot. Bonds7

About N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide

N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide (PubChem CID 43991013) has the molecular formula C21H21N3O3 and a molecular weight of 363.42 g/mol. Its IUPAC name is N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide
PubChem CID43991013
Molecular FormulaC21H21N3O3
Molecular Weight363.42 g/mol
Exact Mass363.16
IUPAC NameN-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide
SMILESCCOc1ccc(-c2ccc(NC(=O)COc3ccc(C)cc3)cc2)nn1
InChIInChI=1S/C21H21N3O3/c1-3-26-21-13-12-19(23-24-21)16-6-8-17(9-7-16)22-20(25)14-27-18-10-4-15(2)5-11-18/h4-13H,3,14H2,1-2H3,(H,22,25)
InChIKeyYMZHWCCVADTYSC-UHFFFAOYSA-N
XLogP3.87
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.42
LogP ≤ 53.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(6-ethoxypyridazin-3-yl)phenyl]-4-methylbenzamide
CID 7593660
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
2-(3,5-dimethoxyphenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]acetamide
CID 43991165
2-(4-chlorophenyl)-N-[4-(6-ethoxypyridazin-3-yl)phenyl]acetamide
CID 8670504
1-[4-(6-ethoxypyridazin-3-yl)phenyl]-3-phenylurea
CID 43991078
1-(2,5-dimethylphenyl)-3-[4-(6-ethoxypyridazin-3-yl)phenyl]urea
CID 43991121
4-ethoxy-N-[4-(6-methoxypyridazin-3-yl)phenyl]benzamide
CID 7593586
2-(4-butoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 4732728
2-(4-methylphenoxy)-N-(4-propoxyphenyl)acetamide
CID 4943007
2-(4-methylphenoxy)-N-[4-(6-morpholin-4-ylpyridazin-3-yl)phenyl]acetamide
CID 43992749
2-methoxy-N-[4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]acetamide
CID 35333453
2-[4-[2-(4-hydroxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methylphenyl)acetamide
CID 71095079

Frequently Asked Questions

What is the IUPAC name of N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide (CID 43991013) is N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide is CCOc1ccc(-c2ccc(NC(=O)COc3ccc(C)cc3)cc2)nn1.
What is the InChIKey of N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide?
The InChIKey is YMZHWCCVADTYSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O3/c1-3-26-21-13-12-19(23-24-21)16-6-8-17(9-7-16)22-20(25)14-27-18-10-4-15(2)5-11-18/h4-13H,3,14H2,1-2H3,(H,22,25).
What are the key properties of N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide?
N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide has a molecular weight of 363.42 g/mol, XLogP of 3.87, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(6-ethoxypyridazin-3-yl)phenyl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 43991013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).