3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide

C19H22N2O4S — CID 2534240

IUPAC3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide
SMILESO=C(CCS(=O)(=O)c1ccccc1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C19H22N2O4S/c22-19(10-15-26(23,24)16-6-2-1-3-7-16)20-17-8-4-5-9-18(17)21-11-13-25-14-12-21/h1-9H,10-15H2,(H,20,22)
InChIKeyUJISUICSSGISBC-UHFFFAOYSA-N
MW374.46 g/mol
LogP2.33
Rot. Bonds6

About 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide

3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide (PubChem CID 2534240) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound Name3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide
PubChem CID2534240
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC Name3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide
SMILESO=C(CCS(=O)(=O)c1ccccc1)Nc1ccccc1N1CCOCC1
InChIInChI=1S/C19H22N2O4S/c22-19(10-15-26(23,24)16-6-2-1-3-7-16)20-17-8-4-5-9-18(17)21-11-13-25-14-12-21/h1-9H,10-15H2,(H,20,22)
InChIKeyUJISUICSSGISBC-UHFFFAOYSA-N
XLogP2.33
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-morpholin-4-ylphenyl)-2-(4-nitrophenyl)sulfanylacetamide
CID 2084437
(2S)-2-(benzenesulfonamido)-3-methyl-N-(2-morpholin-4-ylphenyl)butanamide
CID 2123914
N-(3-fluoro-4-morpholinophenyl)-2-(phenylsulfanyl)acetamide
CID 3753436
N-(5-morpholin-4-ylsulfonyl-2-piperidin-1-ylphenyl)butanamide
CID 4296426
1-(3-(3-Morpholinopropylsulfonyl)phenyl)-3-phenylurea
CID 24809976
N-(4-Cyclohexylsulfamoyl-phenyl)-2-morpholin-4-yl-acetamide
CID 647448
2-[(4-methylphenyl)sulfanyl]-N-[2-(4-morpholinyl)phenyl]acetamide
CID 847697
2-(4-fluorophenyl)sulfanyl-N-(2-morpholin-4-ylphenyl)acetamide
CID 847698
N-(2-morpholin-4-ylphenyl)-2-(5-morpholin-4-ylsulfonylthiophen-2-yl)acetamide
CID 2084205
2-[(2-fluorophenyl)sulfonylamino]-N-(4-morpholin-4-ylphenyl)acetamide
CID 2594456
2-[(4-fluorophenyl)sulfonyl-methylamino]-N-(2-morpholin-4-ylphenyl)acetamide
CID 2677684
2-[(4-methylphenyl)thio]-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide
CID 2948127

Frequently Asked Questions

What is the IUPAC name of 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide?
The IUPAC name of 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide (CID 2534240) is 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide is O=C(CCS(=O)(=O)c1ccccc1)Nc1ccccc1N1CCOCC1.
What is the InChIKey of 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide?
The InChIKey is UJISUICSSGISBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c22-19(10-15-26(23,24)16-6-2-1-3-7-16)20-17-8-4-5-9-18(17)21-11-13-25-14-12-21/h1-9H,10-15H2,(H,20,22).
What are the key properties of 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide?
3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide has a molecular weight of 374.46 g/mol, XLogP of 2.33, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(benzenesulfonyl)-N-(2-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 2534240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).