N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide

C13H20N2O4S — CID 94024917

IUPACN-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide
SMILESCO[C@H](CNS(=O)(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C13H20N2O4S/c1-18-13(12-5-3-2-4-6-12)11-14-20(16,17)15-7-9-19-10-8-15/h2-6,13-14H,7-11H2,1H3/t13-/m1/s1
InChIKeyDTUYQZXWLLHBJQ-CYBMUJFWSA-N
MW300.38 g/mol
LogP0.54
Rot. Bonds6

About N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide

N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide (PubChem CID 94024917) has the molecular formula C13H20N2O4S and a molecular weight of 300.38 g/mol. Its IUPAC name is N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide
PubChem CID94024917
Molecular FormulaC13H20N2O4S
Molecular Weight300.38 g/mol
Exact Mass300.11
IUPAC NameN-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide
SMILESCO[C@H](CNS(=O)(=O)N1CCOCC1)c1ccccc1
InChIInChI=1S/C13H20N2O4S/c1-18-13(12-5-3-2-4-6-12)11-14-20(16,17)15-7-9-19-10-8-15/h2-6,13-14H,7-11H2,1H3/t13-/m1/s1
InChIKeyDTUYQZXWLLHBJQ-CYBMUJFWSA-N
XLogP0.54
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.38
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-hydroxy-2-phenylethyl)morpholine-4-sulfonamide
CID 43502480
N-[(2S)-2-phenyl-2-pyrrolidin-1-ylethyl]morpholine-4-sulfonamide
CID 94177877
N-[(2S)-2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]morpholine-4-sulfonamide
CID 94018205
N-(2,2-diethoxyethyl)morpholine-4-sulfonamide
CID 79548082
N-(2-phenylsulfanylethyl)morpholine-4-sulfonamide
CID 47141638
N-[(4-methoxyphenyl)methyl]morpholine-4-sulfonamide
CID 51335175
N-[(1S)-2-morpholin-4-yl-1-phenylethyl]pyrrolidine-1-sulfonamide
CID 51872327
N-[2-methyl-3-(methylamino)propyl]morpholine-4-sulfonamide
CID 115302914
N-[2-(4-ethoxy-3-methoxyphenyl)-2-(1H-indol-3-yl)ethyl]morpholine-4-sulfonamide
CID 42937618
2-phenyl-3-(pyrrolidin-1-ylsulfonylamino)propanoic acid
CID 62883151
N-[2-(dimethylamino)-2-phenylethyl]piperazine-1-sulfonamide
CID 61252712
4-methoxy-N-[(1S)-2-morpholin-4-yl-1-phenylethyl]benzenesulfonamide
CID 8844917

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide?
The IUPAC name of N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide (CID 94024917) is N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide.
What is the SMILES notation for N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide?
The canonical SMILES for N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide is CO[C@H](CNS(=O)(=O)N1CCOCC1)c1ccccc1.
What is the InChIKey of N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide?
The InChIKey is DTUYQZXWLLHBJQ-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H20N2O4S/c1-18-13(12-5-3-2-4-6-12)11-14-20(16,17)15-7-9-19-10-8-15/h2-6,13-14H,7-11H2,1H3/t13-/m1/s1.
What are the key properties of N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide?
N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide has a molecular weight of 300.38 g/mol, XLogP of 0.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-methoxy-2-phenylethyl]morpholine-4-sulfonamide is sourced from PubChem (CID 94024917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).