4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine

C15H21NO5S — CID 9333066

IUPAC4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine
SMILESO=S(=O)(c1ccc(OC[C@@H]2CCCO2)cc1)N1CCOCC1
InChIInChI=1S/C15H21NO5S/c17-22(18,16-7-10-19-11-8-16)15-5-3-13(4-6-15)21-12-14-2-1-9-20-14/h3-6,14H,1-2,7-12H2/t14-/m0/s1
InChIKeyVJKNEXZEXRMXOZ-AWEZNQCLSA-N
MW327.40 g/mol
LogP1.27
Rot. Bonds5

About 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine

4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine (PubChem CID 9333066) has the molecular formula C15H21NO5S and a molecular weight of 327.40 g/mol. Its IUPAC name is 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine.

Molecular Properties

Compound Name4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine
PubChem CID9333066
Molecular FormulaC15H21NO5S
Molecular Weight327.40 g/mol
Exact Mass327.11
IUPAC Name4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine
SMILESO=S(=O)(c1ccc(OC[C@@H]2CCCO2)cc1)N1CCOCC1
InChIInChI=1S/C15H21NO5S/c17-22(18,16-7-10-19-11-8-16)15-5-3-13(4-6-15)21-12-14-2-1-9-20-14/h3-6,14H,1-2,7-12H2/t14-/m0/s1
InChIKeyVJKNEXZEXRMXOZ-AWEZNQCLSA-N
XLogP1.27
TPSA65.07 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.40
LogP ≤ 51.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxy-5-morpholin-4-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide
CID 42993641
[4-(4-morpholin-4-ylsulfonyl-2-nitrophenyl)piperazin-1-yl]-[4-(oxolan-2-ylmethoxy)phenyl]methanone
CID 4858670
(E)-3-(4-morpholin-4-ylsulfonylphenyl)-N-[3-(oxolan-2-ylmethoxy)phenyl]prop-2-enamide
CID 43055996
3-bromo-N-(4-morpholin-4-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide
CID 17131718
4-(oxolan-2-ylmethoxy)-N-(3-pyrrolidin-1-ylsulfonylphenyl)benzamide
CID 4314126
oxolan-2-ylmethyl 1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxylate
CID 24557079
4-[4-[2-(4-chlorophenoxy)ethoxy]phenyl]sulfonylmorpholine
CID 34198649
N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)-4-(oxolan-2-ylmethoxy)benzamide
CID 4312919
2-(4-morpholin-4-ylsulfonylphenoxy)ethyl cyclobutanecarboxylate
CID 55449133
[2-oxo-2-[[(2S)-oxolan-2-yl]methylamino]ethyl] 4-morpholin-4-ylsulfonylbenzoate
CID 7918875
4-[4-[[(2S)-oxolan-2-yl]methyl]piperazin-1-yl]sulfonylbenzonitrile
CID 9264811
2-[(4-iodophenoxy)methyl]oxolane
CID 60644314

Frequently Asked Questions

What is the IUPAC name of 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine?
The IUPAC name of 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine (CID 9333066) is 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine.
What is the SMILES notation for 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine?
The canonical SMILES for 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine is O=S(=O)(c1ccc(OC[C@@H]2CCCO2)cc1)N1CCOCC1.
What is the InChIKey of 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine?
The InChIKey is VJKNEXZEXRMXOZ-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H21NO5S/c17-22(18,16-7-10-19-11-8-16)15-5-3-13(4-6-15)21-12-14-2-1-9-20-14/h3-6,14H,1-2,7-12H2/t14-/m0/s1.
What are the key properties of 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine?
4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine has a molecular weight of 327.40 g/mol, XLogP of 1.27, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[[(2S)-oxolan-2-yl]methoxy]phenyl]sulfonylmorpholine is sourced from PubChem (CID 9333066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).