N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide

C22H21NO3 — CID 7925397

IUPACN-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C22H21NO3/c1-3-25-18-12-14-19(15-13-18)26-21-7-5-4-6-20(21)23-22(24)17-10-8-16(2)9-11-17/h4-15H,3H2,1-2H3,(H,23,24)
InChIKeyGQKIMCSIMVANSY-UHFFFAOYSA-N
MW347.41 g/mol
LogP5.44
Rot. Bonds6

About N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide

N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide (PubChem CID 7925397) has the molecular formula C22H21NO3 and a molecular weight of 347.41 g/mol. Its IUPAC name is N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide
PubChem CID7925397
Molecular FormulaC22H21NO3
Molecular Weight347.41 g/mol
Exact Mass347.15
IUPAC NameN-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide
SMILESCCOc1ccc(Oc2ccccc2NC(=O)c2ccc(C)cc2)cc1
InChIInChI=1S/C22H21NO3/c1-3-25-18-12-14-19(15-13-18)26-21-7-5-4-6-20(21)23-22(24)17-10-8-16(2)9-11-17/h4-15H,3H2,1-2H3,(H,23,24)
InChIKeyGQKIMCSIMVANSY-UHFFFAOYSA-N
XLogP5.44
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.41
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-acetamido-N-[2-(4-ethoxyphenoxy)phenyl]benzamide
CID 26243690
N-[2-(4-ethoxyphenoxy)phenyl]-4-(ethylsulfamoyl)benzamide
CID 39971958
6-chloro-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide
CID 26243696
4-ethoxy-N-[2-(2-methylpropoxy)phenyl]benzamide
CID 17074278
N-[2-(4-ethoxyphenoxy)phenyl]-2-iodobenzamide
CID 26243693
N-(2-acetamidophenyl)-4-ethoxybenzamide
CID 891466
6-(cyclopropylamino)-N-[2-(4-ethoxyphenoxy)phenyl]pyridine-3-carboxamide
CID 60563554
3-(2-amino-2-oxoethoxy)-N-[2-(4-ethoxyphenoxy)phenyl]benzamide
CID 35680500
N-[2-(4-ethoxyphenoxy)phenyl]-3-nitrobenzamide
CID 7925385
4-ethoxy-3-methoxy-N-(2-phenoxyphenyl)benzamide
CID 24583790
4-ethoxy-N-[2-(3-phenylpropoxy)phenyl]benzamide
CID 17131440
N-(2-ethoxyphenyl)-4-heptoxybenzamide
CID 4950665

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide?
The IUPAC name of N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide (CID 7925397) is N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide.
What is the SMILES notation for N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide?
The canonical SMILES for N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide is CCOc1ccc(Oc2ccccc2NC(=O)c2ccc(C)cc2)cc1.
What is the InChIKey of N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide?
The InChIKey is GQKIMCSIMVANSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO3/c1-3-25-18-12-14-19(15-13-18)26-21-7-5-4-6-20(21)23-22(24)17-10-8-16(2)9-11-17/h4-15H,3H2,1-2H3,(H,23,24).
What are the key properties of N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide?
N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide has a molecular weight of 347.41 g/mol, XLogP of 5.44, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-ethoxyphenoxy)phenyl]-4-methylbenzamide is sourced from PubChem (CID 7925397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).