4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide

C19H22N2O5S — CID 2664930

IUPAC4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)cc2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C19H22N2O5S/c1-14-3-6-16(7-4-14)20-19(22)15-5-8-17(25-2)18(13-15)27(23,24)21-9-11-26-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22)
InChIKeyOVJOGWSZIRZSQA-UHFFFAOYSA-N
MW390.46 g/mol
LogP2.28
Rot. Bonds5

About 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide

4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide (PubChem CID 2664930) has the molecular formula C19H22N2O5S and a molecular weight of 390.46 g/mol. Its IUPAC name is 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound Name4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide
PubChem CID2664930
Molecular FormulaC19H22N2O5S
Molecular Weight390.46 g/mol
Exact Mass390.12
IUPAC Name4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide
SMILESCOc1ccc(C(=O)Nc2ccc(C)cc2)cc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C19H22N2O5S/c1-14-3-6-16(7-4-14)20-19(22)15-5-8-17(25-2)18(13-15)27(23,24)21-9-11-26-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22)
InChIKeyOVJOGWSZIRZSQA-UHFFFAOYSA-N
XLogP2.28
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-N-[4-(4-methylphenoxy)phenyl]-3-morpholin-4-ylsulfonylbenzamide
CID 2676641
N-(4-carbamoylphenyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
CID 7926425
N-(3-chloro-4-methoxyphenyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
CID 18892295
3-fluoro-4-methoxy-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)benzamide
CID 25438460
propyl 4-[(4-methoxy-3-morpholin-4-ylsulfonylbenzoyl)amino]benzoate
CID 4849600
N-(4-chloro-3-cyanophenyl)-4-methoxy-3-morpholin-4-ylsulfonylbenzamide
CID 55480876
4-methoxy-3-morpholin-4-ylsulfonyl-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 5058872
N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)-4-morpholin-4-ylsulfonylbenzamide
CID 100679263
4-[(4-methoxy-3-morpholin-4-ylsulfonylbenzoyl)amino]-N,3-dimethylbenzamide
CID 46465140
N-(4-iodophenyl)-4-methoxy-3-pyrrolidin-1-ylsulfonylbenzamide
CID 1310055
N-(4-acetylphenyl)-3-(azepan-1-ylsulfonyl)-4-methoxybenzamide
CID 17434438
4-chloro-N-(4-methoxy-3-morpholin-4-ylsulfonylphenyl)-3-nitrobenzamide
CID 26174414

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide (CID 2664930) is 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide is COc1ccc(C(=O)Nc2ccc(C)cc2)cc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide?
The InChIKey is OVJOGWSZIRZSQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O5S/c1-14-3-6-16(7-4-14)20-19(22)15-5-8-17(25-2)18(13-15)27(23,24)21-9-11-26-12-10-21/h3-8,13H,9-12H2,1-2H3,(H,20,22).
What are the key properties of 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide?
4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide has a molecular weight of 390.46 g/mol, XLogP of 2.28, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-methylphenyl)-3-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 2664930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).