5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide

C14H20N2O5S — CID 146024510

IUPAC5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2(C)C)cc1C(N)=O
InChIInChI=1S/C14H20N2O5S/c1-14(2)9-21-7-6-16(14)22(18,19)10-4-5-12(20-3)11(8-10)13(15)17/h4-5,8H,6-7,9H2,1-3H3,(H2,15,17)
InChIKeyCFAXAJOXFNOJBS-UHFFFAOYSA-N
MW328.39 g/mol
LogP0.59
Rot. Bonds4

About 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide

5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide (PubChem CID 146024510) has the molecular formula C14H20N2O5S and a molecular weight of 328.39 g/mol. Its IUPAC name is 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide.

Molecular Properties

Compound Name5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide
PubChem CID146024510
Molecular FormulaC14H20N2O5S
Molecular Weight328.39 g/mol
Exact Mass328.11
IUPAC Name5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide
SMILESCOc1ccc(S(=O)(=O)N2CCOCC2(C)C)cc1C(N)=O
InChIInChI=1S/C14H20N2O5S/c1-14(2)9-21-7-6-16(14)22(18,19)10-4-5-12(20-3)11(8-10)13(15)17/h4-5,8H,6-7,9H2,1-3H3,(H2,15,17)
InChIKeyCFAXAJOXFNOJBS-UHFFFAOYSA-N
XLogP0.59
TPSA98.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide 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

4-(4-methoxy-3-methylphenyl)sulfonyl-3,3-dimethylmorpholine
CID 112507401
4-(3-chloro-4-methoxyphenyl)sulfonyl-3,3-dimethylmorpholine
CID 47387477
5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-fluorobenzenecarbothioamide
CID 63289053
4-(4-methoxyphenyl)sulfonyl-3,3-dimethylmorpholine
CID 112507393
5-[4-(4-chlorophenyl)-2,2-dimethylpiperazin-1-yl]sulfonyl-2-methoxybenzamide
CID 139009484
4-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-(trifluoromethyl)benzoic acid
CID 146132870
2-methoxy-5-(4-methylsulfonylpiperazin-1-yl)sulfonylbenzamide
CID 171134280
[2-chloro-4-(3,3-dimethylmorpholin-4-yl)sulfonylphenyl]methanol
CID 107090677
2-methoxy-5-[(4-morpholin-4-ylphenyl)sulfamoyl]benzamide
CID 39324008
2-methoxy-5-[4-(methylamino)piperidin-1-yl]sulfonylbenzamide;hydrochloride
CID 119979778
2-methoxy-5-(4-methyl-3-oxopiperazin-1-yl)sulfonylbenzamide
CID 146024506
2-methoxy-5-sulfamoylbenzamide;hydrochloride
CID 22748858

Frequently Asked Questions

What is the IUPAC name of 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide?
The IUPAC name of 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide (CID 146024510) is 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide.
What is the SMILES notation for 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide?
The canonical SMILES for 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide is COc1ccc(S(=O)(=O)N2CCOCC2(C)C)cc1C(N)=O.
What is the InChIKey of 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide?
The InChIKey is CFAXAJOXFNOJBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O5S/c1-14(2)9-21-7-6-16(14)22(18,19)10-4-5-12(20-3)11(8-10)13(15)17/h4-5,8H,6-7,9H2,1-3H3,(H2,15,17).
What are the key properties of 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide?
5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide has a molecular weight of 328.39 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3,3-dimethylmorpholin-4-yl)sulfonyl-2-methoxybenzamide is sourced from PubChem (CID 146024510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).