2-(benzenesulfonyl)morpholine

C10H13NO3S — CID 19848023

IUPAC2-(benzenesulfonyl)morpholine
SMILESO=S(=O)(c1ccccc1)C1CNCCO1
InChIInChI=1S/C10H13NO3S/c12-15(13,9-4-2-1-3-5-9)10-8-11-6-7-14-10/h1-5,10-11H,6-8H2
InChIKeyIXYCQZXROQCJII-UHFFFAOYSA-N
MW227.28 g/mol
LogP0.41
Rot. Bonds2

About 2-(benzenesulfonyl)morpholine

2-(benzenesulfonyl)morpholine (PubChem CID 19848023) has the molecular formula C10H13NO3S and a molecular weight of 227.28 g/mol. Its IUPAC name is 2-(benzenesulfonyl)morpholine.

Molecular Properties

Compound Name2-(benzenesulfonyl)morpholine
PubChem CID19848023
Molecular FormulaC10H13NO3S
Molecular Weight227.28 g/mol
Exact Mass227.06
IUPAC Name2-(benzenesulfonyl)morpholine
SMILESO=S(=O)(c1ccccc1)C1CNCCO1
InChIInChI=1S/C10H13NO3S/c12-15(13,9-4-2-1-3-5-9)10-8-11-6-7-14-10/h1-5,10-11H,6-8H2
InChIKeyIXYCQZXROQCJII-UHFFFAOYSA-N
XLogP0.41
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.28
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-fluorophenyl)sulfonylmorpholine
CID 117037120
2-(4-propan-2-ylphenyl)sulfonylmorpholine
CID 117037126
2-[4-(5-phenyl-1,3-oxazol-2-yl)phenyl]sulfonylmorpholine
CID 24961513
2-(benzenesulfonyl)oxolane
CID 10998330
2-(4-cyclopropylsulfonylphenyl)morpholine
CID 117421824
3-(benzenesulfonyl)piperidine;ethane
CID 142376077
[4-(benzenesulfonyl)piperazin-1-yl]-morpholin-2-ylmethanone
CID 119678332
azane;2-phenylmorpholine
CID 174664757
2-(benzenesulfinyl)morpholine
CID 174861338
morpholin-2-ylmethyl phenylmethanesulfonate
CID 175699328
3-[(2R)-morpholin-2-yl]benzoic acid
CID 169449190
(2S)-2-(4-methylsulfonylphenyl)morpholine
CID 93302356

Frequently Asked Questions

What is the IUPAC name of 2-(benzenesulfonyl)morpholine?
The IUPAC name of 2-(benzenesulfonyl)morpholine (CID 19848023) is 2-(benzenesulfonyl)morpholine.
What is the SMILES notation for 2-(benzenesulfonyl)morpholine?
The canonical SMILES for 2-(benzenesulfonyl)morpholine is O=S(=O)(c1ccccc1)C1CNCCO1.
What is the InChIKey of 2-(benzenesulfonyl)morpholine?
The InChIKey is IXYCQZXROQCJII-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO3S/c12-15(13,9-4-2-1-3-5-9)10-8-11-6-7-14-10/h1-5,10-11H,6-8H2.
What are the key properties of 2-(benzenesulfonyl)morpholine?
2-(benzenesulfonyl)morpholine has a molecular weight of 227.28 g/mol, XLogP of 0.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzenesulfonyl)morpholine is sourced from PubChem (CID 19848023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).