N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide

C19H23NO3 — CID 90597947

IUPACN-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide
SMILESCOc1ccccc1C(CNC(=O)c1ccc(C)cc1C)OC
InChIInChI=1S/C19H23NO3/c1-13-9-10-15(14(2)11-13)19(21)20-12-18(23-4)16-7-5-6-8-17(16)22-3/h5-11,18H,12H2,1-4H3,(H,20,21)
InChIKeyZGRISEVNWKMOCF-UHFFFAOYSA-N
MW313.40 g/mol
LogP3.43
Rot. Bonds6

About N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide

N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide (PubChem CID 90597947) has the molecular formula C19H23NO3 and a molecular weight of 313.40 g/mol. Its IUPAC name is N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide.

Molecular Properties

Compound NameN-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide
PubChem CID90597947
Molecular FormulaC19H23NO3
Molecular Weight313.40 g/mol
Exact Mass313.17
IUPAC NameN-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide
SMILESCOc1ccccc1C(CNC(=O)c1ccc(C)cc1C)OC
InChIInChI=1S/C19H23NO3/c1-13-9-10-15(14(2)11-13)19(21)20-12-18(23-4)16-7-5-6-8-17(16)22-3/h5-11,18H,12H2,1-4H3,(H,20,21)
InChIKeyZGRISEVNWKMOCF-UHFFFAOYSA-N
XLogP3.43
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methoxy-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598704
2,3,4-trimethoxy-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598793
N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2-methylsulfanylbenzamide
CID 90597977
5-bromo-2-chloro-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]benzamide
CID 90598056
N-[2-(3-fluorophenyl)-2-methoxyethyl]-2,4-dimethylbenzamide
CID 90622908
N-(2-bromo-2-phenylethyl)-2,4-dimethylbenzamide
CID 114308285
N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2-oxochromene-3-carboxamide
CID 90598012
N-[2-(2-methoxyphenyl)-2-[[2-(2-oxopyrrolidin-3-yl)acetyl]amino]ethyl]-2,4-dimethylbenzamide
CID 154872910
N-[2-methoxy-2-(2-methylphenyl)ethyl]-3,5-dimethylbenzamide
CID 90598696
N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2-(2-methylphenoxy)acetamide
CID 90597971
2,4-dichloro-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598769
2-chloro-6-fluoro-N-[2-methoxy-2-(2-methoxyphenyl)ethyl]benzamide
CID 90597986

Frequently Asked Questions

What is the IUPAC name of N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide?
The IUPAC name of N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide (CID 90597947) is N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide.
What is the SMILES notation for N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide?
The canonical SMILES for N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide is COc1ccccc1C(CNC(=O)c1ccc(C)cc1C)OC.
What is the InChIKey of N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide?
The InChIKey is ZGRISEVNWKMOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO3/c1-13-9-10-15(14(2)11-13)19(21)20-12-18(23-4)16-7-5-6-8-17(16)22-3/h5-11,18H,12H2,1-4H3,(H,20,21).
What are the key properties of N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide?
N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide has a molecular weight of 313.40 g/mol, XLogP of 3.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2,4-dimethylbenzamide is sourced from PubChem (CID 90597947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).