3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide

C19H22N2O3 — CID 134054424

IUPAC3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
SMILESCc1ccc(C(C)N(C)C(=O)c2cccc(OCC(N)=O)c2)cc1
InChIInChI=1S/C19H22N2O3/c1-13-7-9-15(10-8-13)14(2)21(3)19(23)16-5-4-6-17(11-16)24-12-18(20)22/h4-11,14H,12H2,1-3H3,(H2,20,22)
InChIKeyZFFHHLADADHEHX-UHFFFAOYSA-N
MW326.40 g/mol
LogP2.69
Rot. Bonds6

About 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide

3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide (PubChem CID 134054424) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide.

Molecular Properties

Compound Name3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
PubChem CID134054424
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
SMILESCc1ccc(C(C)N(C)C(=O)c2cccc(OCC(N)=O)c2)cc1
InChIInChI=1S/C19H22N2O3/c1-13-7-9-15(10-8-13)14(2)21(3)19(23)16-5-4-6-17(11-16)24-12-18(20)22/h4-11,14H,12H2,1-3H3,(H2,20,22)
InChIKeyZFFHHLADADHEHX-UHFFFAOYSA-N
XLogP2.69
TPSA72.63 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-fluoro-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
CID 134054213
N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide
CID 60737715
3-(difluoromethoxy)-N-[1-(4-methoxyphenyl)ethyl]-N-methylbenzamide
CID 75869929
3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-methyl-N-(1-phenylethyl)benzamide
CID 51188159
3-(2-amino-2-oxoethoxy)benzoic acid
CID 961591
N-[1-(4-fluorophenyl)ethyl]-N-methyl-3-(pyridin-3-ylmethoxy)benzamide
CID 55772817
3-hydroxy-N-[1-(4-hydroxyphenyl)ethyl]-N-methylbenzamide
CID 61044546
2-(4-acetylphenoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide
CID 134054389
4-(2-amino-2-oxoethoxy)-N-[1-(furan-2-yl)ethyl]-N-methylbenzamide
CID 50981914
3-(2-amino-2-oxoethoxy)-N-methyl-N-[(4-methylsulfanylphenyl)methyl]benzamide
CID 35689866
2-(3-methoxyphenyl)-N-methyl-N-[1-(4-methylphenyl)ethyl]acetamide
CID 134054231
N-(1-hydroxy-1-phenylpropan-2-yl)-N-methyl-3-(2-methylprop-2-enoxy)benzamide
CID 54856661

Frequently Asked Questions

What is the IUPAC name of 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide?
The IUPAC name of 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide (CID 134054424) is 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide.
What is the SMILES notation for 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide?
The canonical SMILES for 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide is Cc1ccc(C(C)N(C)C(=O)c2cccc(OCC(N)=O)c2)cc1.
What is the InChIKey of 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide?
The InChIKey is ZFFHHLADADHEHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-13-7-9-15(10-8-13)14(2)21(3)19(23)16-5-4-6-17(11-16)24-12-18(20)22/h4-11,14H,12H2,1-3H3,(H2,20,22).
What are the key properties of 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide?
3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide has a molecular weight of 326.40 g/mol, XLogP of 2.69, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-amino-2-oxoethoxy)-N-methyl-N-[1-(4-methylphenyl)ethyl]benzamide is sourced from PubChem (CID 134054424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).