3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide

C23H23NO2 — CID 20803221

IUPAC3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide
SMILESCOc1ccc(-c2cc(C(=O)N[C@H](C)c3ccccc3)ccc2C)cc1
InChIInChI=1S/C23H23NO2/c1-16-9-10-20(15-22(16)19-11-13-21(26-3)14-12-19)23(25)24-17(2)18-7-5-4-6-8-18/h4-15,17H,1-3H3,(H,24,25)/t17-/m1/s1
InChIKeyUMJCWKDDKLTMIM-QGZVFWFLSA-N
MW345.44 g/mol
LogP5.16
Rot. Bonds5

About 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide

3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide (PubChem CID 20803221) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide
PubChem CID20803221
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC Name3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide
SMILESCOc1ccc(-c2cc(C(=O)N[C@H](C)c3ccccc3)ccc2C)cc1
InChIInChI=1S/C23H23NO2/c1-16-9-10-20(15-22(16)19-11-13-21(26-3)14-12-19)23(25)24-17(2)18-7-5-4-6-8-18/h4-15,17H,1-3H3,(H,24,25)/t17-/m1/s1
InChIKeyUMJCWKDDKLTMIM-QGZVFWFLSA-N
XLogP5.16
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500345.44
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(1S)-1-(4-methoxyphenyl)ethyl]-4-phenylbenzamide
CID 977346
3-methoxy-4-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 26009148
4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide
CID 40950006
1-N,4-N-bis[(1S)-1-(4-methoxyphenyl)ethyl]benzene-1,4-dicarboxamide
CID 2211003
N-[(1S)-1-(4-methoxyphenyl)ethyl]-4-methyl-3-(phenylsulfamoyl)benzamide
CID 99958629
N-[(1R)-1-phenylethyl]naphthalene-2-carboxamide
CID 814202
3,5-dimethoxy-N-[(1R)-1-(4-phenylphenyl)ethyl]benzamide
CID 7948871
3,4-dimethoxy-N-[(1S)-1-(4-methoxyphenyl)ethyl]benzamide
CID 831207
4-methoxy-N-[(1R)-1-naphthalen-2-ylethyl]benzamide
CID 977744
4-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 730323
3-(4-methoxyphenyl)-N-[(1S)-1-phenylethyl]-1,2,4-thiadiazole-5-carboxamide
CID 54133730
2,4-dimethoxy-N-[(1S)-1-phenylethyl]benzamide
CID 814199

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide?
The IUPAC name of 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide (CID 20803221) is 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide.
What is the SMILES notation for 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide?
The canonical SMILES for 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide is COc1ccc(-c2cc(C(=O)N[C@H](C)c3ccccc3)ccc2C)cc1.
What is the InChIKey of 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide?
The InChIKey is UMJCWKDDKLTMIM-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H23NO2/c1-16-9-10-20(15-22(16)19-11-13-21(26-3)14-12-19)23(25)24-17(2)18-7-5-4-6-8-18/h4-15,17H,1-3H3,(H,24,25)/t17-/m1/s1.
What are the key properties of 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide?
3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide has a molecular weight of 345.44 g/mol, XLogP of 5.16, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxyphenyl)-4-methyl-N-[(1R)-1-phenylethyl]benzamide is sourced from PubChem (CID 20803221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).