N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide

C28H25NO3 — CID 166328881

IUPACN-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide
SMILESCOc1cccc(COc2cccc(NC(=O)c3ccccc3-c3ccccc3)c2C)c1
InChIInChI=1S/C28H25NO3/c1-20-26(16-9-17-27(20)32-19-21-10-8-13-23(18-21)31-2)29-28(30)25-15-7-6-14-24(25)22-11-4-3-5-12-22/h3-18H,19H2,1-2H3,(H,29,30)
InChIKeyQTSDWPCDXYJSNV-UHFFFAOYSA-N
MW423.51 g/mol
LogP6.50
Rot. Bonds7

About N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide

N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide (PubChem CID 166328881) has the molecular formula C28H25NO3 and a molecular weight of 423.51 g/mol. Its IUPAC name is N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide
PubChem CID166328881
Molecular FormulaC28H25NO3
Molecular Weight423.51 g/mol
Exact Mass423.18
IUPAC NameN-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide
SMILESCOc1cccc(COc2cccc(NC(=O)c3ccccc3-c3ccccc3)c2C)c1
InChIInChI=1S/C28H25NO3/c1-20-26(16-9-17-27(20)32-19-21-10-8-13-23(18-21)31-2)29-28(30)25-15-7-6-14-24(25)22-11-4-3-5-12-22/h3-18H,19H2,1-2H3,(H,29,30)
InChIKeyQTSDWPCDXYJSNV-UHFFFAOYSA-N
XLogP6.50
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500423.51
LogP ≤ 56.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide
CID 84590450
N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-1,2-oxazole-3-carboxamide
CID 75433097
2-chloro-2-fluoro-N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]acetamide
CID 166427866
N-(3-methoxyphenyl)-2-(2-phenylmethoxyanilino)acetamide
CID 54827854
2,4-dimethoxy-N-(2-phenylphenyl)benzamide
CID 26727528
N-(2-hydroxyphenyl)-2-[(3-methylphenyl)methoxy]benzamide
CID 25494578
1-methoxy-3-[(2-methylphenoxy)methyl]benzene
CID 59416569
[2-(3-methoxyanilino)-2-oxoethyl] 2-[(3-methylphenyl)methoxy]benzoate
CID 7771223
methyl 3-[[2-[(2-methylphenyl)carbamoyl]phenoxy]methyl]benzoate
CID 2995814
N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]-3-phenyl-1,2-oxazole-5-carboxamide
CID 55666254
N-(2-ethoxyphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
CID 110382396
N-(2,3-dimethylphenyl)-1-[(3-methoxyphenyl)methoxy]-2-oxopyridine-3-carboxamide
CID 110382730

Frequently Asked Questions

What is the IUPAC name of N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide?
The IUPAC name of N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide (CID 166328881) is N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide.
What is the SMILES notation for N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide?
The canonical SMILES for N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide is COc1cccc(COc2cccc(NC(=O)c3ccccc3-c3ccccc3)c2C)c1.
What is the InChIKey of N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide?
The InChIKey is QTSDWPCDXYJSNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H25NO3/c1-20-26(16-9-17-27(20)32-19-21-10-8-13-23(18-21)31-2)29-28(30)25-15-7-6-14-24(25)22-11-4-3-5-12-22/h3-18H,19H2,1-2H3,(H,29,30).
What are the key properties of N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide?
N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide has a molecular weight of 423.51 g/mol, XLogP of 6.50, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(3-methoxyphenyl)methoxy]-2-methylphenyl]-2-phenylbenzamide is sourced from PubChem (CID 166328881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).