N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide

C19H22N2O4S — CID 86864071

IUPACN-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide
SMILESCC(NS(=O)(=O)c1ccccc1-c1ccccc1)C(=O)N1CCOCC1
InChIInChI=1S/C19H22N2O4S/c1-15(19(22)21-11-13-25-14-12-21)20-26(23,24)18-10-6-5-9-17(18)16-7-3-2-4-8-16/h2-10,15,20H,11-14H2,1H3
InChIKeyGDLUYYWPIAXJRV-UHFFFAOYSA-N
MW374.46 g/mol
LogP1.88
Rot. Bonds5

About N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide

N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide (PubChem CID 86864071) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide.

Molecular Properties

Compound NameN-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide
PubChem CID86864071
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide
SMILESCC(NS(=O)(=O)c1ccccc1-c1ccccc1)C(=O)N1CCOCC1
InChIInChI=1S/C19H22N2O4S/c1-15(19(22)21-11-13-25-14-12-21)20-26(23,24)18-10-6-5-9-17(18)16-7-3-2-4-8-16/h2-10,15,20H,11-14H2,1H3
InChIKeyGDLUYYWPIAXJRV-UHFFFAOYSA-N
XLogP1.88
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1-morpholin-4-yl-1-oxopropan-2-yl)-1-phenylmethanesulfonamide
CID 51087827
N-[(2S)-1-[4-(morpholine-4-carbonyl)piperidin-1-yl]-1-oxopropan-2-yl]-2-(trifluoromethyl)benzenesulfonamide
CID 55938474
4-chloro-N-(1-morpholin-4-yl-1-oxopropan-2-yl)benzenesulfonamide
CID 2955346
2-chloro-N-[(2S)-3-methyl-1-morpholin-4-yl-1-oxobutan-2-yl]benzenesulfonamide
CID 110348840
2-methoxy-N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)benzenesulfonamide
CID 51097874
2-methoxy-N-[(2R)-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]benzenesulfonamide
CID 94799743
2-methyl-N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]benzenesulfonamide
CID 110348278
N-[(2S)-1-(azepan-1-yl)-1-oxopropan-2-yl]benzenesulfonamide
CID 51089554
2-[(1-hydroxy-2-phenylpropan-2-yl)amino]-1-morpholin-4-ylpropan-1-one
CID 105058043
4-ethoxy-N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]benzenesulfonamide
CID 110347837
2-anilino-N-(1-morpholin-4-yl-1-oxopropan-2-yl)acetamide
CID 115673259
N-(1-morpholin-4-yl-1-oxopropan-2-yl)-1H-pyrazole-4-sulfonamide
CID 47470284

Frequently Asked Questions

What is the IUPAC name of N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide?
The IUPAC name of N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide (CID 86864071) is N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide.
What is the SMILES notation for N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide?
The canonical SMILES for N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide is CC(NS(=O)(=O)c1ccccc1-c1ccccc1)C(=O)N1CCOCC1.
What is the InChIKey of N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide?
The InChIKey is GDLUYYWPIAXJRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-15(19(22)21-11-13-25-14-12-21)20-26(23,24)18-10-6-5-9-17(18)16-7-3-2-4-8-16/h2-10,15,20H,11-14H2,1H3.
What are the key properties of N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide?
N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide has a molecular weight of 374.46 g/mol, XLogP of 1.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-morpholin-4-yl-1-oxopropan-2-yl)-2-phenylbenzenesulfonamide is sourced from PubChem (CID 86864071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).