N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide

C20H24N2O3 — CID 51292786

IUPACN-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide
SMILESCCOc1ccc(C(C)NC(=O)CNC(=O)c2ccccc2C)cc1
InChIInChI=1S/C20H24N2O3/c1-4-25-17-11-9-16(10-12-17)15(3)22-19(23)13-21-20(24)18-8-6-5-7-14(18)2/h5-12,15H,4,13H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyJGGIQTMMQHBFSE-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.00
Rot. Bonds7

About N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide

N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide (PubChem CID 51292786) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide.

Molecular Properties

Compound NameN-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide
PubChem CID51292786
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC NameN-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide
SMILESCCOc1ccc(C(C)NC(=O)CNC(=O)c2ccccc2C)cc1
InChIInChI=1S/C20H24N2O3/c1-4-25-17-11-9-16(10-12-17)15(3)22-19(23)13-21-20(24)18-8-6-5-7-14(18)2/h5-12,15H,4,13H2,1-3H3,(H,21,24)(H,22,23)
InChIKeyJGGIQTMMQHBFSE-UHFFFAOYSA-N
XLogP3.00
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-N-[2-oxo-2-(1-phenylethylamino)ethyl]benzamide
CID 42702795
2-ethoxy-N-[2-[1-(4-fluorophenyl)ethylamino]-2-oxoethyl]benzamide
CID 46654191
N-[(1R)-1-(4-ethoxyphenyl)ethyl]-2-phenylacetamide
CID 880798
N-[2-[(2E)-2-[(4-ethoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-2-methylbenzamide
CID 45054416
2-amino-N-[4-[1-(4-ethoxyphenyl)ethylamino]-4-oxobutyl]benzamide
CID 119946012
2-(tert-butylamino)-N-[1-(4-ethoxyphenyl)ethyl]acetamide
CID 47844270
N-[2-[(4-ethoxyphenyl)methyl-methylamino]-2-oxoethyl]-2-methylbenzamide
CID 51161257
2-chloro-N-[2-[[(1R)-1-(3,4-diethoxyphenyl)ethyl]amino]-2-oxoethyl]benzamide
CID 9418929
[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl] 2-[(4-ethoxybenzoyl)amino]acetate
CID 7884921
[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl] 2-[(4-ethoxybenzoyl)amino]acetate
CID 7884920
N-[(1S)-1-(4-ethoxyphenyl)ethyl]-2-phenylsulfanylacetamide
CID 28954114
2-ethoxy-N-[1-(4-ethoxyphenyl)ethyl]acetamide
CID 60706778

Frequently Asked Questions

What is the IUPAC name of N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide?
The IUPAC name of N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide (CID 51292786) is N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide.
What is the SMILES notation for N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide?
The canonical SMILES for N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide is CCOc1ccc(C(C)NC(=O)CNC(=O)c2ccccc2C)cc1.
What is the InChIKey of N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide?
The InChIKey is JGGIQTMMQHBFSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-4-25-17-11-9-16(10-12-17)15(3)22-19(23)13-21-20(24)18-8-6-5-7-14(18)2/h5-12,15H,4,13H2,1-3H3,(H,21,24)(H,22,23).
What are the key properties of N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide?
N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide has a molecular weight of 340.42 g/mol, XLogP of 3.00, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[1-(4-ethoxyphenyl)ethylamino]-2-oxoethyl]-2-methylbenzamide is sourced from PubChem (CID 51292786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).