4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide

C19H22N2O5S — CID 110286966

IUPAC4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)N[C@H](C(=O)N2CCOCC2)c2ccccc2)cc1
InChIInChI=1S/C19H22N2O5S/c1-25-16-7-9-17(10-8-16)27(23,24)20-18(15-5-3-2-4-6-15)19(22)21-11-13-26-14-12-21/h2-10,18,20H,11-14H2,1H3/t18-/m0/s1
InChIKeyZQEFHEIIZULYRB-SFHVURJKSA-N
MW390.46 g/mol
LogP1.57
Rot. Bonds6

About 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide

4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide (PubChem CID 110286966) has the molecular formula C19H22N2O5S and a molecular weight of 390.46 g/mol. Its IUPAC name is 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide.

Molecular Properties

Compound Name4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide
PubChem CID110286966
Molecular FormulaC19H22N2O5S
Molecular Weight390.46 g/mol
Exact Mass390.12
IUPAC Name4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide
SMILESCOc1ccc(S(=O)(=O)N[C@H](C(=O)N2CCOCC2)c2ccccc2)cc1
InChIInChI=1S/C19H22N2O5S/c1-25-16-7-9-17(10-8-16)27(23,24)20-18(15-5-3-2-4-6-15)19(22)21-11-13-26-14-12-21/h2-10,18,20H,11-14H2,1H3/t18-/m0/s1
InChIKeyZQEFHEIIZULYRB-SFHVURJKSA-N
XLogP1.57
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.46
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-methyl-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide
CID 110286976
2-[(4-methoxyphenyl)sulfonylamino]-2-phenylacetic acid
CID 500044
N-[2-[4-[(4-fluorophenyl)methyl]piperazin-1-yl]-2-oxo-1-phenylethyl]-4-methoxybenzenesulfonamide
CID 71689976
4-[(2S)-2-(dimethylsulfamoylamino)-2-phenylacetyl]morpholine
CID 110286962
4-methoxy-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzenesulfonamide
CID 8844917
4-methoxy-N-[1-(4-methoxyphenyl)-3-morpholin-4-yl-3-oxopropyl]benzenesulfonamide
CID 25046566
N-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-2-oxo-1-phenylethyl]thiophene-2-sulfonamide
CID 15991705
(2-morpholin-4-yl-2-oxo-1-phenylethyl) 4-methoxybenzoate
CID 18198778
N-[3-hydroxy-1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]-4-methoxybenzenesulfonamide
CID 4108774
N-[(S)-(4-methoxyphenyl)-phenylmethyl]morpholine-4-carboxamide
CID 94513081
[(2R)-1-morpholin-4-yl-1-oxopropan-2-yl] 4-[(4-methoxyphenyl)sulfamoyl]benzoate
CID 25331106
4-ethoxy-N-[(2S)-1-morpholin-4-yl-1-oxopropan-2-yl]benzenesulfonamide
CID 110347837

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide?
The IUPAC name of 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide (CID 110286966) is 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide.
What is the SMILES notation for 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide?
The canonical SMILES for 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide is COc1ccc(S(=O)(=O)N[C@H](C(=O)N2CCOCC2)c2ccccc2)cc1.
What is the InChIKey of 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide?
The InChIKey is ZQEFHEIIZULYRB-SFHVURJKSA-N. The full InChI is InChI=1S/C19H22N2O5S/c1-25-16-7-9-17(10-8-16)27(23,24)20-18(15-5-3-2-4-6-15)19(22)21-11-13-26-14-12-21/h2-10,18,20H,11-14H2,1H3/t18-/m0/s1.
What are the key properties of 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide?
4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide has a molecular weight of 390.46 g/mol, XLogP of 1.57, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]benzenesulfonamide is sourced from PubChem (CID 110286966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).