N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide

C19H23NO2 — CID 90598696

IUPACN-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide
SMILESCOC(CNC(=O)c1cc(C)cc(C)c1)c1ccccc1C
InChIInChI=1S/C19H23NO2/c1-13-9-14(2)11-16(10-13)19(21)20-12-18(22-4)17-8-6-5-7-15(17)3/h5-11,18H,12H2,1-4H3,(H,20,21)
InChIKeyQNZADUJVRDWICL-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.73
Rot. Bonds5

About N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide

N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide (PubChem CID 90598696) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide
PubChem CID90598696
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC NameN-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide
SMILESCOC(CNC(=O)c1cc(C)cc(C)c1)c1ccccc1C
InChIInChI=1S/C19H23NO2/c1-13-9-14(2)11-16(10-13)19(21)20-12-18(22-4)17-8-6-5-7-15(17)3/h5-11,18H,12H2,1-4H3,(H,20,21)
InChIKeyQNZADUJVRDWICL-UHFFFAOYSA-N
XLogP3.73
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-fluoro-N-[(2R)-2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 97417642
N-[2-hydroxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide
CID 111119847
N-[2-methoxy-2-(2-methylphenyl)ethyl]-4-propylbenzamide
CID 90598713
N-[(2S)-2-methoxy-2-(2-methylphenyl)ethyl]-2,1,3-benzothiadiazole-5-carboxamide
CID 97417689
N-[2-methoxy-2-(2-methylphenyl)ethyl]-N'-(2,4,6-trimethylphenyl)oxamide
CID 90598970
2-methoxy-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598704
1-[(2R)-2-methoxy-2-(2-methylphenyl)ethyl]-3-propan-2-ylurea
CID 97417874
2,4-dichloro-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598769
1-[(2R)-2-methoxy-2-(2-methylphenyl)ethyl]-3-(2-methylphenyl)urea
CID 97417882
N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,3-dimethylbutanamide
CID 90598675
2,3,4-trimethoxy-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598793
N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide
CID 90597947

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide?
The IUPAC name of N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide (CID 90598696) is N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide.
What is the SMILES notation for N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide?
The canonical SMILES for N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide is COC(CNC(=O)c1cc(C)cc(C)c1)c1ccccc1C.
What is the InChIKey of N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide?
The InChIKey is QNZADUJVRDWICL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-13-9-14(2)11-16(10-13)19(21)20-12-18(22-4)17-8-6-5-7-15(17)3/h5-11,18H,12H2,1-4H3,(H,20,21).
What are the key properties of N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide?
N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide has a molecular weight of 297.40 g/mol, XLogP of 3.73, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide is sourced from PubChem (CID 90598696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).