2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide

C24H25NO3 — CID 55801218

IUPAC2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
SMILESCOCCOc1cccc(CNC(=O)c2ccccc2Cc2ccccc2)c1
InChIInChI=1S/C24H25NO3/c1-27-14-15-28-22-12-7-10-20(17-22)18-25-24(26)23-13-6-5-11-21(23)16-19-8-3-2-4-9-19/h2-13,17H,14-16,18H2,1H3,(H,25,26)
InChIKeyWPAJARTVBAEGIW-UHFFFAOYSA-N
MW375.47 g/mol
LogP4.23
Rot. Bonds9

About 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide

2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide (PubChem CID 55801218) has the molecular formula C24H25NO3 and a molecular weight of 375.47 g/mol. Its IUPAC name is 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
PubChem CID55801218
Molecular FormulaC24H25NO3
Molecular Weight375.47 g/mol
Exact Mass375.18
IUPAC Name2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
SMILESCOCCOc1cccc(CNC(=O)c2ccccc2Cc2ccccc2)c1
InChIInChI=1S/C24H25NO3/c1-27-14-15-28-22-12-7-10-20(17-22)18-25-24(26)23-13-6-5-11-21(23)16-19-8-3-2-4-9-19/h2-13,17H,14-16,18H2,1H3,(H,25,26)
InChIKeyWPAJARTVBAEGIW-UHFFFAOYSA-N
XLogP4.23
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.47
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-benzyl-N-[[3-(1-methylpiperidin-4-yl)oxyphenyl]methyl]benzamide
CID 69193811
2-(methoxymethyl)-N-[[3-[[[2-(methoxymethyl)benzoyl]amino]methyl]phenyl]methyl]benzamide
CID 121289726
2-(4-methoxyanilino)-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
CID 55857881
2,5-difluoro-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
CID 87005454
1-[3-(2-methoxyethoxy)phenyl]-N-[(2-methylphenyl)methyl]methanamine
CID 54803561
N-[[3-(2-methoxyethoxy)phenyl]methyl]-2-methyl-3-(methylamino)propanamide;hydrochloride
CID 119723323
2-benzoyl-N-[(3-ethoxyphenyl)methyl]benzamide
CID 55843893
5-[[3-(2-methoxyethoxy)phenyl]methylcarbamoyl]pyrazine-2-carboxylic acid
CID 120688954
4-bromo-2-fluoro-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide
CID 166179858
2-benzyl-N-[(6-methoxy-3-pyridinyl)methyl]benzamide
CID 51316857
N-[[3-(2-methoxyethoxy)phenyl]methyl]-4-methyl-2-phenyl-1,3-thiazole-5-carboxamide
CID 55804099
2-(4-aminophenyl)-N-[[3-(2-methoxyethoxy)phenyl]methyl]acetamide;hydrochloride
CID 119723299

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide?
The IUPAC name of 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide (CID 55801218) is 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide.
What is the SMILES notation for 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide?
The canonical SMILES for 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide is COCCOc1cccc(CNC(=O)c2ccccc2Cc2ccccc2)c1.
What is the InChIKey of 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide?
The InChIKey is WPAJARTVBAEGIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25NO3/c1-27-14-15-28-22-12-7-10-20(17-22)18-25-24(26)23-13-6-5-11-21(23)16-19-8-3-2-4-9-19/h2-13,17H,14-16,18H2,1H3,(H,25,26).
What are the key properties of 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide?
2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide has a molecular weight of 375.47 g/mol, XLogP of 4.23, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-N-[[3-(2-methoxyethoxy)phenyl]methyl]benzamide is sourced from PubChem (CID 55801218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).