4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide

C19H23N3O3 — CID 54817374

IUPAC4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide
SMILESCCNC(=O)c1ccc(NC(=O)CNc2ccccc2OCC)cc1
InChIInChI=1S/C19H23N3O3/c1-3-20-19(24)14-9-11-15(12-10-14)22-18(23)13-21-16-7-5-6-8-17(16)25-4-2/h5-12,21H,3-4,13H2,1-2H3,(H,20,24)(H,22,23)
InChIKeySHIGDSIEMLGCCU-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.89
Rot. Bonds8

About 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide

4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide (PubChem CID 54817374) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide.

Molecular Properties

Compound Name4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide
PubChem CID54817374
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide
SMILESCCNC(=O)c1ccc(NC(=O)CNc2ccccc2OCC)cc1
InChIInChI=1S/C19H23N3O3/c1-3-20-19(24)14-9-11-15(12-10-14)22-18(23)13-21-16-7-5-6-8-17(16)25-4-2/h5-12,21H,3-4,13H2,1-2H3,(H,20,24)(H,22,23)
InChIKeySHIGDSIEMLGCCU-UHFFFAOYSA-N
XLogP2.89
TPSA79.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-ethyl-4-[[2-(2-methoxyanilino)acetyl]amino]benzamide
CID 54817444
2-(2-ethoxyanilino)-N-(4-methoxyphenyl)acetamide
CID 26438880
propyl 4-[[2-(2-ethoxyanilino)acetyl]amino]benzoate
CID 54817296
N-ethyl-4-[[2-[4-(ethylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 54839505
4-[[2-[2-(2-phenoxyethoxy)anilino]acetyl]amino]-N-propylbenzamide
CID 54827216
4-[[2-(2-butoxyanilino)acetyl]amino]-N-methylbenzamide
CID 54828140
N-ethyl-4-[[2-oxo-2-(2-propan-2-yloxyanilino)ethyl]amino]benzamide
CID 54839172
N-ethyl-4-[[2-oxo-2-[4-(2-phenoxyethoxy)anilino]ethyl]amino]benzamide
CID 54839113
3-[[2-(2,5-diethoxyanilino)acetyl]amino]-N-ethylbenzamide
CID 41397412
ethyl 4-[[2-(2-ethoxyanilino)-2-oxoethyl]amino]benzoate
CID 51178437
2-(2-ethoxyanilino)-N-[4-(2-methylprop-2-enoxy)phenyl]acetamide
CID 54817171
N-methyl-4-[[2-[2-(2-methylpropoxy)anilino]acetyl]amino]benzamide
CID 54823920

Frequently Asked Questions

What is the IUPAC name of 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide?
The IUPAC name of 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide (CID 54817374) is 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide.
What is the SMILES notation for 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide?
The canonical SMILES for 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide is CCNC(=O)c1ccc(NC(=O)CNc2ccccc2OCC)cc1.
What is the InChIKey of 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide?
The InChIKey is SHIGDSIEMLGCCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-3-20-19(24)14-9-11-15(12-10-14)22-18(23)13-21-16-7-5-6-8-17(16)25-4-2/h5-12,21H,3-4,13H2,1-2H3,(H,20,24)(H,22,23).
What are the key properties of 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide?
4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide has a molecular weight of 341.41 g/mol, XLogP of 2.89, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[2-(2-ethoxyanilino)acetyl]amino]-N-ethylbenzamide is sourced from PubChem (CID 54817374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).