2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide

C18H18N2O3 — CID 2492527

IUPAC2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)COc2ccc(C#N)cc2OC)cc1
InChIInChI=1S/C18H18N2O3/c1-3-13-4-7-15(8-5-13)20-18(21)12-23-16-9-6-14(11-19)10-17(16)22-2/h4-10H,3,12H2,1-2H3,(H,20,21)
InChIKeyZQSBVBJTMQVPFV-UHFFFAOYSA-N
MW310.35 g/mol
LogP3.15
Rot. Bonds6

About 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide

2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide (PubChem CID 2492527) has the molecular formula C18H18N2O3 and a molecular weight of 310.35 g/mol. Its IUPAC name is 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide
PubChem CID2492527
Molecular FormulaC18H18N2O3
Molecular Weight310.35 g/mol
Exact Mass310.13
IUPAC Name2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)COc2ccc(C#N)cc2OC)cc1
InChIInChI=1S/C18H18N2O3/c1-3-13-4-7-15(8-5-13)20-18(21)12-23-16-9-6-14(11-19)10-17(16)22-2/h4-10H,3,12H2,1-2H3,(H,20,21)
InChIKeyZQSBVBJTMQVPFV-UHFFFAOYSA-N
XLogP3.15
TPSA71.35 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.35
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-cyano-2-methoxyphenoxy)-N-[4-(diethylamino)phenyl]acetamide
CID 55309601
2-[4-[[2-(4-cyano-2-methoxyphenoxy)acetyl]amino]phenyl]-2-methylpropanoic acid
CID 119253821
2-(4-cyano-2-methoxyphenoxy)-N-[4-(diethylsulfamoyl)phenyl]acetamide
CID 2492497
5-[[2-(4-cyano-2-methoxyphenoxy)acetyl]amino]benzene-1,3-dicarboxamide
CID 41070274
2-(4-cyano-2-methoxyphenoxy)-N-[3-[(dimethylamino)methyl]phenyl]acetamide
CID 86932038
N-(4-tert-butylphenyl)-2-(4-cyano-2-ethoxyphenoxy)acetamide
CID 7993191
2-(4-cyano-2-methoxyphenoxy)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide
CID 16511665
2-(4-cyano-2-methoxyphenoxy)-N-(4-fluoro-3-nitrophenyl)acetamide
CID 4845177
2-(4-cyano-2-methoxyphenoxy)-N-(4-methoxy-2,5-dimethylphenyl)acetamide
CID 2976145
2-(2-chloro-4-cyanophenoxy)-N-(4-methoxyphenyl)acetamide
CID 8975814
2-(2,6-dimethoxy-4-methylphenoxy)-N-(4-ethylphenyl)acetamide
CID 7686490
N-carbamoyl-2-(4-cyano-2-methoxyphenoxy)acetamide
CID 2492394

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide?
The IUPAC name of 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide (CID 2492527) is 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide.
What is the SMILES notation for 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide?
The canonical SMILES for 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide is CCc1ccc(NC(=O)COc2ccc(C#N)cc2OC)cc1.
What is the InChIKey of 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide?
The InChIKey is ZQSBVBJTMQVPFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O3/c1-3-13-4-7-15(8-5-13)20-18(21)12-23-16-9-6-14(11-19)10-17(16)22-2/h4-10H,3,12H2,1-2H3,(H,20,21).
What are the key properties of 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide?
2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide has a molecular weight of 310.35 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyano-2-methoxyphenoxy)-N-(4-ethylphenyl)acetamide is sourced from PubChem (CID 2492527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).