2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide

C22H21NO3 — CID 52577778

IUPAC2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide
SMILESCOCc1ccccc1C(=O)Nc1ccc(Oc2cccc(C)c2)cc1
InChIInChI=1S/C22H21NO3/c1-16-6-5-8-20(14-16)26-19-12-10-18(11-13-19)23-22(24)21-9-4-3-7-17(21)15-25-2/h3-14H,15H2,1-2H3,(H,23,24)
InChIKeyYMOGXYZLDRWFTA-UHFFFAOYSA-N
MW347.41 g/mol
LogP5.19
Rot. Bonds6

About 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide

2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide (PubChem CID 52577778) has the molecular formula C22H21NO3 and a molecular weight of 347.41 g/mol. Its IUPAC name is 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide.

Molecular Properties

Compound Name2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide
PubChem CID52577778
Molecular FormulaC22H21NO3
Molecular Weight347.41 g/mol
Exact Mass347.15
IUPAC Name2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide
SMILESCOCc1ccccc1C(=O)Nc1ccc(Oc2cccc(C)c2)cc1
InChIInChI=1S/C22H21NO3/c1-16-6-5-8-20(14-16)26-19-12-10-18(11-13-19)23-22(24)21-9-4-3-7-17(21)15-25-2/h3-14H,15H2,1-2H3,(H,23,24)
InChIKeyYMOGXYZLDRWFTA-UHFFFAOYSA-N
XLogP5.19
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 ≤ 55.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[(4-ethoxyphenyl)carbamoyl]phenyl]-2-(methoxymethyl)benzamide
CID 39089763
3-(methoxymethyl)-2-methyl-N-phenylbenzamide
CID 151203902
N-(4-acetylphenyl)-4-(3-methylphenoxy)benzamide
CID 16650962
N-[4-(3-methylphenoxy)phenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 2511417
2-benzyl-N-(4-phenoxyphenyl)benzamide
CID 7914966
4-fluoro-N-[4-(3-methylphenoxy)phenyl]benzamide
CID 2114068
N-(4-chlorophenyl)-4-(3-methylphenoxy)benzamide
CID 16650944
2-methoxy-N-[4-(3-methylphenoxy)phenyl]-5-sulfamoylbenzamide
CID 9453672
2-(3-methylphenoxy)-N-(4-phenoxyphenyl)propanamide
CID 3937440
2-(4-chlorophenyl)-N-[4-(3-methylphenoxy)phenyl]acetamide
CID 5085866
N-[4-(3-methylphenoxy)phenyl]-4-(methylsulfanylmethyl)benzamide
CID 7925023
2-(2,5-dimethoxyphenyl)-N-[4-(3-methylphenoxy)phenyl]acetamide
CID 7581668

Frequently Asked Questions

What is the IUPAC name of 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide?
The IUPAC name of 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide (CID 52577778) is 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide.
What is the SMILES notation for 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide?
The canonical SMILES for 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide is COCc1ccccc1C(=O)Nc1ccc(Oc2cccc(C)c2)cc1.
What is the InChIKey of 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide?
The InChIKey is YMOGXYZLDRWFTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO3/c1-16-6-5-8-20(14-16)26-19-12-10-18(11-13-19)23-22(24)21-9-4-3-7-17(21)15-25-2/h3-14H,15H2,1-2H3,(H,23,24).
What are the key properties of 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide?
2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide has a molecular weight of 347.41 g/mol, XLogP of 5.19, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methoxymethyl)-N-[4-(3-methylphenoxy)phenyl]benzamide is sourced from PubChem (CID 52577778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).