N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide

C19H23NO4 — CID 134053714

IUPACN-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide
SMILESCOCc1cccc(C(=O)NC(C)c2ccc(OC)cc2OC)c1
InChIInChI=1S/C19H23NO4/c1-13(17-9-8-16(23-3)11-18(17)24-4)20-19(21)15-7-5-6-14(10-15)12-22-2/h5-11,13H,12H2,1-4H3,(H,20,21)
InChIKeySUZOHGYLVDBWMA-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.34
Rot. Bonds7

About N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide

N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide (PubChem CID 134053714) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide.

Molecular Properties

Compound NameN-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide
PubChem CID134053714
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC NameN-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide
SMILESCOCc1cccc(C(=O)NC(C)c2ccc(OC)cc2OC)c1
InChIInChI=1S/C19H23NO4/c1-13(17-9-8-16(23-3)11-18(17)24-4)20-19(21)15-7-5-6-14(10-15)12-22-2/h5-11,13H,12H2,1-4H3,(H,20,21)
InChIKeySUZOHGYLVDBWMA-UHFFFAOYSA-N
XLogP3.34
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethoxyphenyl)-3-(methoxymethyl)benzamide
CID 7603182
N-[1-[1-(2,4-dimethoxyphenyl)ethylamino]-1-oxopropan-2-yl]-3-methylbenzamide
CID 86995853
methyl 4-[[(1R)-1-(2,4-dimethoxyphenyl)ethyl]carbamoyl]benzoate
CID 94045094
N-[1-(2,4-dimethoxyphenyl)ethyl]-3-pyrrolidin-1-ylsulfonylbenzamide
CID 55579424
N-[1-[1-(2,4-dimethoxyphenyl)ethylamino]-3-methyl-1-oxobutan-2-yl]-3-methylbenzamide
CID 55580663
N-[1-(3,4-diethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide
CID 78808076
2-[[3-(methoxymethyl)benzoyl]amino]propanoic acid
CID 43170851
N-[1-(2,4-dimethoxyphenyl)ethyl]-1H-pyrazole-4-carboxamide
CID 60968183
3-(methoxymethyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 31110060
3-bromo-N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]benzamide
CID 1323549
N-[1-(2,5-dimethoxyphenyl)ethyl]-3-fluorobenzamide
CID 2918181
N-(1-amino-1-oxopropan-2-yl)-3-(methoxymethyl)benzamide
CID 134045690

Frequently Asked Questions

What is the IUPAC name of N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide?
The IUPAC name of N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide (CID 134053714) is N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide.
What is the SMILES notation for N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide?
The canonical SMILES for N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide is COCc1cccc(C(=O)NC(C)c2ccc(OC)cc2OC)c1.
What is the InChIKey of N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide?
The InChIKey is SUZOHGYLVDBWMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-13(17-9-8-16(23-3)11-18(17)24-4)20-19(21)15-7-5-6-14(10-15)12-22-2/h5-11,13H,12H2,1-4H3,(H,20,21).
What are the key properties of N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide?
N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide has a molecular weight of 329.40 g/mol, XLogP of 3.34, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2,4-dimethoxyphenyl)ethyl]-3-(methoxymethyl)benzamide is sourced from PubChem (CID 134053714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).