3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide

C20H22N2O4 — CID 17205535

IUPAC3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
SMILESCCOc1cccc(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)c1
InChIInChI=1S/C20H22N2O4/c1-2-26-18-8-4-5-15(14-18)19(23)21-17-7-3-6-16(13-17)20(24)22-9-11-25-12-10-22/h3-8,13-14H,2,9-12H2,1H3,(H,21,23)
InChIKeyBEFVXQREJWWVIR-UHFFFAOYSA-N
MW354.41 g/mol
LogP2.81
Rot. Bonds5

About 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide

3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide (PubChem CID 17205535) has the molecular formula C20H22N2O4 and a molecular weight of 354.41 g/mol. Its IUPAC name is 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide.

Molecular Properties

Compound Name3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
PubChem CID17205535
Molecular FormulaC20H22N2O4
Molecular Weight354.41 g/mol
Exact Mass354.16
IUPAC Name3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
SMILESCCOc1cccc(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)c1
InChIInChI=1S/C20H22N2O4/c1-2-26-18-8-4-5-15(14-18)19(23)21-17-7-3-6-16(13-17)20(24)22-9-11-25-12-10-22/h3-8,13-14H,2,9-12H2,1H3,(H,21,23)
InChIKeyBEFVXQREJWWVIR-UHFFFAOYSA-N
XLogP2.81
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.41
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(morpholine-4-carbonyl)phenyl]-3-propoxybenzamide
CID 17205539
4-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
CID 17205497
3-ethoxy-N-[2-(morpholine-4-carbonyl)phenyl]benzamide
CID 4957459
4-ethoxy-N-[[3-(morpholine-4-carbonyl)phenyl]carbamothioyl]benzamide
CID 17205854
3-propoxy-N-[3-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 26161679
3-ethoxy-N-[4-(pyrrolidine-1-carbonyl)phenyl]benzamide
CID 17196395
3-methoxy-4-methyl-N-[3-(morpholine-4-carbonyl)phenyl]benzamide
CID 55748732
[4-(3-ethoxybenzoyl)piperazin-1-yl]-(3-ethoxyphenyl)methanone
CID 4958094
ethyl 4-[[3-(morpholine-4-carbonyl)benzoyl]amino]benzoate
CID 109052957
methyl 5-[(3-ethoxybenzoyl)amino]-2-morpholin-4-ylbenzoate
CID 6463110
N-[3-(azepane-1-carbonyl)phenyl]-3-(2-phenoxyethoxy)benzamide
CID 26159512
3-(2-phenoxyethoxy)-N-[3-(piperidine-1-carbonyl)phenyl]benzamide
CID 26168534

Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide?
The IUPAC name of 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide (CID 17205535) is 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide.
What is the SMILES notation for 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide?
The canonical SMILES for 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide is CCOc1cccc(C(=O)Nc2cccc(C(=O)N3CCOCC3)c2)c1.
What is the InChIKey of 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide?
The InChIKey is BEFVXQREJWWVIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O4/c1-2-26-18-8-4-5-15(14-18)19(23)21-17-7-3-6-16(13-17)20(24)22-9-11-25-12-10-22/h3-8,13-14H,2,9-12H2,1H3,(H,21,23).
What are the key properties of 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide?
3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide has a molecular weight of 354.41 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-[3-(morpholine-4-carbonyl)phenyl]benzamide is sourced from PubChem (CID 17205535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).