4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide

C20H25N3O3 — CID 25396160

IUPAC4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide
SMILESCCOc1ccc(C(=O)NCC(=O)NCCN(C)c2ccccc2)cc1
InChIInChI=1S/C20H25N3O3/c1-3-26-18-11-9-16(10-12-18)20(25)22-15-19(24)21-13-14-23(2)17-7-5-4-6-8-17/h4-12H,3,13-15H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyFPKLYRFEZQUZJG-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.07
Rot. Bonds9

About 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide

4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide (PubChem CID 25396160) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide
PubChem CID25396160
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide
SMILESCCOc1ccc(C(=O)NCC(=O)NCCN(C)c2ccccc2)cc1
InChIInChI=1S/C20H25N3O3/c1-3-26-18-11-9-16(10-12-18)20(25)22-15-19(24)21-13-14-23(2)17-7-5-4-6-8-17/h4-12H,3,13-15H2,1-2H3,(H,21,24)(H,22,25)
InChIKeyFPKLYRFEZQUZJG-UHFFFAOYSA-N
XLogP2.07
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]-4-phenylbenzamide
CID 36941546
2-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide
CID 25396087
1-N,4-N-bis[2-(N-methylanilino)ethyl]benzene-1,4-dicarboxamide
CID 35617422
N-[2-[2-[[2-(4-ethoxyphenyl)acetyl]amino]ethylamino]-2-oxoethyl]benzamide
CID 108539279
N-[2-(butylamino)-2-oxoethyl]-4-ethoxybenzamide
CID 34231237
4-(difluoromethoxy)-N-[2-(N-methylanilino)ethyl]benzamide
CID 25394977
4-ethoxy-N-[2-[2-(4-methylphenoxy)ethylamino]-2-oxoethyl]benzamide
CID 9366137
4-chloro-N-[2-[2-(4-ethoxyphenoxy)ethylamino]-2-oxoethyl]benzamide
CID 9022553
N-[2-[2-(2,6-difluorophenyl)ethylamino]-2-oxoethyl]-4-ethoxybenzamide
CID 60547662
4-ethoxy-N-(2-hydrazinyl-2-oxoethyl)benzamide
CID 17349908
3-[2-[[2-[(4-ethoxybenzoyl)amino]acetyl]amino]ethyl]benzoic acid
CID 120535479
4-ethoxy-N-[2-oxo-2-(2-thiophen-2-ylethylamino)ethyl]benzamide
CID 27770384

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide?
The IUPAC name of 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide (CID 25396160) is 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide?
The canonical SMILES for 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide is CCOc1ccc(C(=O)NCC(=O)NCCN(C)c2ccccc2)cc1.
What is the InChIKey of 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide?
The InChIKey is FPKLYRFEZQUZJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-3-26-18-11-9-16(10-12-18)20(25)22-15-19(24)21-13-14-23(2)17-7-5-4-6-8-17/h4-12H,3,13-15H2,1-2H3,(H,21,24)(H,22,25).
What are the key properties of 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide?
4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide has a molecular weight of 355.44 g/mol, XLogP of 2.07, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-N-[2-[2-(N-methylanilino)ethylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 25396160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).