3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide

C18H20N2O3 — CID 31524865

IUPAC3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide
SMILESCCc1cccc(OCC(=O)Nc2cccc(C(=O)NC)c2)c1
InChIInChI=1S/C18H20N2O3/c1-3-13-6-4-9-16(10-13)23-12-17(21)20-15-8-5-7-14(11-15)18(22)19-2/h4-11H,3,12H2,1-2H3,(H,19,22)(H,20,21)
InChIKeyJAHJGOWXJOOSBX-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.63
Rot. Bonds6

About 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide

3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide (PubChem CID 31524865) has the molecular formula C18H20N2O3 and a molecular weight of 312.37 g/mol. Its IUPAC name is 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide.

Molecular Properties

Compound Name3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide
PubChem CID31524865
Molecular FormulaC18H20N2O3
Molecular Weight312.37 g/mol
Exact Mass312.15
IUPAC Name3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide
SMILESCCc1cccc(OCC(=O)Nc2cccc(C(=O)NC)c2)c1
InChIInChI=1S/C18H20N2O3/c1-3-13-6-4-9-16(10-13)23-12-17(21)20-15-8-5-7-14(11-15)18(22)19-2/h4-11H,3,12H2,1-2H3,(H,19,22)(H,20,21)
InChIKeyJAHJGOWXJOOSBX-UHFFFAOYSA-N
XLogP2.63
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-3-[[2-(3-ethylphenoxy)acetyl]amino]benzamide
CID 26993706
3-[[[2-(3-ethylphenoxy)acetyl]amino]methyl]-N-methylbenzamide
CID 33203040
2-(3-bromophenoxy)-N-(3-ethylphenyl)acetamide
CID 7935227
dimethyl 5-[[2-(3-ethylphenoxy)acetyl]amino]benzene-1,3-dicarboxylate
CID 2711605
2-(3-ethylphenoxy)-N-(3-fluorophenyl)acetamide
CID 2709979
3-[[2-(3,4-dichlorophenoxy)acetyl]amino]-N-methylbenzamide
CID 9196891
2-(3-ethylphenoxy)-N-(4-hydroxyphenyl)acetamide
CID 51186827
2-(3-ethylphenoxy)-N-(3-heptoxyphenyl)acetamide
CID 43912190
N-methyl-3-[[2-[4-(2-methylbutan-2-yl)phenoxy]acetyl]amino]benzamide
CID 17233162
2-(3-ethylphenoxy)-N-pyridin-3-ylacetamide
CID 26592501
N-(3-amino-4-ethylphenyl)-2-(3-ethylphenoxy)acetamide
CID 28867409
N-(3-ethylphenyl)-2-[4-(methylamino)phenoxy]acetamide
CID 61028344

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide?
The IUPAC name of 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide (CID 31524865) is 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide.
What is the SMILES notation for 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide?
The canonical SMILES for 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide is CCc1cccc(OCC(=O)Nc2cccc(C(=O)NC)c2)c1.
What is the InChIKey of 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide?
The InChIKey is JAHJGOWXJOOSBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O3/c1-3-13-6-4-9-16(10-13)23-12-17(21)20-15-8-5-7-14(11-15)18(22)19-2/h4-11H,3,12H2,1-2H3,(H,19,22)(H,20,21).
What are the key properties of 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide?
3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide has a molecular weight of 312.37 g/mol, XLogP of 2.63, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(3-ethylphenoxy)acetyl]amino]-N-methylbenzamide is sourced from PubChem (CID 31524865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).