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

C17H19NO2 — CID 40950006

IUPAC4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide
SMILESCOc1ccc(C(=O)N[C@H](C)c2ccccc2)cc1C
InChIInChI=1S/C17H19NO2/c1-12-11-15(9-10-16(12)20-3)17(19)18-13(2)14-7-5-4-6-8-14/h4-11,13H,1-3H3,(H,18,19)/t13-/m1/s1
InChIKeyQJSLGHHFNBSSKV-CYBMUJFWSA-N
MW269.34 g/mol
LogP3.49
Rot. Bonds4

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

4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide (PubChem CID 40950006) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide
PubChem CID40950006
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC Name4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide
SMILESCOc1ccc(C(=O)N[C@H](C)c2ccccc2)cc1C
InChIInChI=1S/C17H19NO2/c1-12-11-15(9-10-16(12)20-3)17(19)18-13(2)14-7-5-4-6-8-14/h4-11,13H,1-3H3,(H,18,19)/t13-/m1/s1
InChIKeyQJSLGHHFNBSSKV-CYBMUJFWSA-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-4-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 26009148
N-[1-(3,4-dimethoxyphenyl)ethyl]-4-methoxy-3-methylbenzamide
CID 43874097
3-fluoro-4-methoxy-N-(1-phenylethyl)benzamide
CID 51194681
3,5-dimethoxy-4-methyl-N-[(1S)-1-phenylethyl]benzamide
CID 2557457
4-methoxy-3-methyl-N-[(R)-(4-methylphenyl)-phenylmethyl]benzamide
CID 100771245
4-methoxy-3-[[(1R)-1-phenylethyl]carbamoyl]benzoic acid
CID 129054309
N-[1-(2,5-dimethoxyphenyl)ethyl]-4-methoxy-3-methylbenzamide
CID 133160272
4-ethoxy-N-[(1S)-1-(2-methoxyphenyl)ethyl]-3-methylbenzamide
CID 28558287
3,4-diethoxy-N-(1-phenylethyl)benzamide
CID 3369950
4-methoxy-3-[(4-methylphenoxy)methyl]-N-(1-phenylethyl)benzamide
CID 133150012
4-methoxy-N-[1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]-3-methylbenzamide
CID 133217534
3,4-dimethoxy-N-[1-(4-propan-2-ylphenyl)ethyl]benzamide
CID 17328593

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide?
The IUPAC name of 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide (CID 40950006) is 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide.
What is the SMILES notation for 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide?
The canonical SMILES for 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide is COc1ccc(C(=O)N[C@H](C)c2ccccc2)cc1C.
What is the InChIKey of 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide?
The InChIKey is QJSLGHHFNBSSKV-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H19NO2/c1-12-11-15(9-10-16(12)20-3)17(19)18-13(2)14-7-5-4-6-8-14/h4-11,13H,1-3H3,(H,18,19)/t13-/m1/s1.
What are the key properties of 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide?
4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]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 4-methoxy-3-methyl-N-[(1R)-1-phenylethyl]benzamide is sourced from PubChem (CID 40950006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).