3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide

C22H27N3O4 — CID 48581819

IUPAC3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
SMILESCCOc1cccc(C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)c1
InChIInChI=1S/C22H27N3O4/c1-2-29-20-5-3-4-18(16-20)22(27)24-19-8-6-17(7-9-19)21(26)23-10-11-25-12-14-28-15-13-25/h3-9,16H,2,10-15H2,1H3,(H,23,26)(H,24,27)
InChIKeyORKXJIMRYLQXCG-UHFFFAOYSA-N
MW397.48 g/mol
LogP2.40
Rot. Bonds8

About 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide

3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide (PubChem CID 48581819) has the molecular formula C22H27N3O4 and a molecular weight of 397.48 g/mol. Its IUPAC name is 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide.

Molecular Properties

Compound Name3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
PubChem CID48581819
Molecular FormulaC22H27N3O4
Molecular Weight397.48 g/mol
Exact Mass397.20
IUPAC Name3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
SMILESCCOc1cccc(C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)c1
InChIInChI=1S/C22H27N3O4/c1-2-29-20-5-3-4-18(16-20)22(27)24-19-8-6-17(7-9-19)21(26)23-10-11-25-12-14-28-15-13-25/h3-9,16H,2,10-15H2,1H3,(H,23,26)(H,24,27)
InChIKeyORKXJIMRYLQXCG-UHFFFAOYSA-N
XLogP2.40
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.48
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide 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

3-fluoro-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 48581644
3-ethoxy-N-[6-(2-morpholin-4-ylethoxy)-3-pyridinyl]benzamide
CID 84559063
3-ethoxy-N-(2-piperazin-1-ylethyl)benzamide
CID 119447922
3-N-(3-acetylphenyl)-1-N-(2-morpholin-4-ylethyl)benzene-1,3-dicarboxamide
CID 109053343
4-N-(2-ethoxyphenyl)-1-N-(2-morpholin-4-ylethyl)benzene-1,4-dicarboxamide
CID 109045923
4-[(4-chlorobenzoyl)amino]-N-(2-morpholin-4-ylethyl)benzamide
CID 48581606
3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
CID 17205535
3-ethoxy-N-[4-(4-methylpiperazin-1-yl)phenyl]benzamide
CID 834145
3-ethoxy-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]benzamide
CID 55882954
3-benzamido-4-methyl-N-(2-morpholin-4-ylethyl)benzamide
CID 17226356
3-bromo-N-(2-morpholin-4-ylethyl)benzamide
CID 669309
4-(ethylamino)-N-(2-morpholin-4-ylethyl)benzamide
CID 62166054

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide?
The IUPAC name of 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide (CID 48581819) is 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide.
What is the SMILES notation for 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide?
The canonical SMILES for 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide is CCOc1cccc(C(=O)Nc2ccc(C(=O)NCCN3CCOCC3)cc2)c1.
What is the InChIKey of 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide?
The InChIKey is ORKXJIMRYLQXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N3O4/c1-2-29-20-5-3-4-18(16-20)22(27)24-19-8-6-17(7-9-19)21(26)23-10-11-25-12-14-28-15-13-25/h3-9,16H,2,10-15H2,1H3,(H,23,26)(H,24,27).
What are the key properties of 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide?
3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide has a molecular weight of 397.48 g/mol, XLogP of 2.40, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[4-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide is sourced from PubChem (CID 48581819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).