2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide

C17H19NO2 — CID 43876733

IUPAC2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide
SMILESCOc1ccccc1C(=O)NC(C)c1ccc(C)cc1
InChIInChI=1S/C17H19NO2/c1-12-8-10-14(11-9-12)13(2)18-17(19)15-6-4-5-7-16(15)20-3/h4-11,13H,1-3H3,(H,18,19)
InChIKeyKWSXJSIHWCERMR-UHFFFAOYSA-N
MW269.34 g/mol
LogP3.49
Rot. Bonds4

About 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide

2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide (PubChem CID 43876733) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide
PubChem CID43876733
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide
SMILESCOc1ccccc1C(=O)NC(C)c1ccc(C)cc1
InChIInChI=1S/C17H19NO2/c1-12-8-10-14(11-9-12)13(2)18-17(19)15-6-4-5-7-16(15)20-3/h4-11,13H,1-3H3,(H,18,19)
InChIKeyKWSXJSIHWCERMR-UHFFFAOYSA-N
XLogP3.49
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-methoxy-N-[(1R)-1-(4-methylphenyl)ethyl]naphthalene-2-carboxamide
CID 28633409
2-methyl-N-[(1S)-1-(4-methylphenyl)ethyl]benzamide
CID 30386627
2-methoxy-N-[(2S)-3-methylbutan-2-yl]benzamide
CID 94867704
2-methoxy-N-[1-(2-methylphenyl)ethyl]benzamide
CID 18111879
2-fluoro-N-[1-(4-methylphenyl)ethyl]benzamide
CID 46590164
2-iodo-N-[1-(4-methylphenyl)ethyl]benzamide
CID 2981930
2-hydroxy-3-methoxy-N-(1-phenylethyl)benzamide
CID 43176488
N-[1-(4-bromophenyl)ethyl]-2-methoxy-5-methylbenzamide
CID 60666490
2-methoxy-N-(1-phenylethylcarbamothioyl)benzamide
CID 2959068
N-[1-(3,4-dimethoxyphenyl)ethyl]-2-methylbenzamide
CID 2894493
N-[(1R)-1-phenylethyl]-2-propan-2-yloxybenzamide
CID 92666015
N-[1-(3,4-dimethylphenyl)ethyl]-2-propan-2-yloxybenzamide
CID 132650471

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide?
The IUPAC name of 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide (CID 43876733) is 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide.
What is the SMILES notation for 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide?
The canonical SMILES for 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide is COc1ccccc1C(=O)NC(C)c1ccc(C)cc1.
What is the InChIKey of 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide?
The InChIKey is KWSXJSIHWCERMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO2/c1-12-8-10-14(11-9-12)13(2)18-17(19)15-6-4-5-7-16(15)20-3/h4-11,13H,1-3H3,(H,18,19).
What are the key properties of 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide?
2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide has a molecular weight of 269.34 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[1-(4-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 43876733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).