(2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine

C15H22N2O4S — CID 98786694

IUPAC(2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine
SMILESC[C@@H]1CN(S(=O)(=O)N2CCOCC2)C[C@@H](c2ccccc2)O1
InChIInChI=1S/C15H22N2O4S/c1-13-11-17(22(18,19)16-7-9-20-10-8-16)12-15(21-13)14-5-3-2-4-6-14/h2-6,13,15H,7-12H2,1H3/t13-,15+/m1/s1
InChIKeyJWGPRVRFJUBPRF-HIFRSBDPSA-N
MW326.42 g/mol
LogP1.03
Rot. Bonds3

About (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine

(2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine (PubChem CID 98786694) has the molecular formula C15H22N2O4S and a molecular weight of 326.42 g/mol. Its IUPAC name is (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine.

Molecular Properties

Compound Name(2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine
PubChem CID98786694
Molecular FormulaC15H22N2O4S
Molecular Weight326.42 g/mol
Exact Mass326.13
IUPAC Name(2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine
SMILESC[C@@H]1CN(S(=O)(=O)N2CCOCC2)C[C@@H](c2ccccc2)O1
InChIInChI=1S/C15H22N2O4S/c1-13-11-17(22(18,19)16-7-9-20-10-8-16)12-15(21-13)14-5-3-2-4-6-14/h2-6,13,15H,7-12H2,1H3/t13-,15+/m1/s1
InChIKeyJWGPRVRFJUBPRF-HIFRSBDPSA-N
XLogP1.03
TPSA59.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.42
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2,6-dimethyl-4-(4-phenylpiperazin-1-yl)sulfonylmorpholine
CID 51330482
[(2S,6S)-2-methyl-6-phenylmorpholin-4-yl]-(4-morpholin-4-ylsulfonylphenyl)methanone
CID 52535688
4-[(4S)-3,3-dimethyl-4-phenylpyrrolidin-1-yl]sulfonylmorpholine
CID 97143928
2-methyl-6-phenyl-4-(2-phenylethylsulfonyl)morpholine
CID 47958840
2-methyl-4-[(4-methylphenyl)methylsulfonyl]-6-phenylmorpholine
CID 110369031
(2S,6S)-2-methyl-4-(4-nitrophenyl)sulfonyl-6-phenylmorpholine
CID 95220723
N-[4-(2-methyl-6-phenylmorpholin-4-yl)sulfonylphenyl]acetamide
CID 47958927
4-(4-fluoro-3-methylphenyl)sulfonyl-2-methyl-6-phenylmorpholine
CID 110369020
4-(2,4-dimethoxyphenyl)sulfonyl-2-methyl-6-phenylmorpholine
CID 110369024
(2-methyl-6-phenylmorpholin-4-yl)-(5-piperidin-1-ylsulfonylfuran-2-yl)methanone
CID 47913591
4-(1-benzylpyrazol-4-yl)sulfonyl-2-methyl-6-phenylmorpholine
CID 86870426
1-[(2R,6S)-2-methyl-6-phenylmorpholin-4-yl]-2-(1-morpholin-4-ylcyclopentyl)ethanone
CID 95772472

Frequently Asked Questions

What is the IUPAC name of (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine?
The IUPAC name of (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine (CID 98786694) is (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine.
What is the SMILES notation for (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine?
The canonical SMILES for (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine is C[C@@H]1CN(S(=O)(=O)N2CCOCC2)C[C@@H](c2ccccc2)O1.
What is the InChIKey of (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine?
The InChIKey is JWGPRVRFJUBPRF-HIFRSBDPSA-N. The full InChI is InChI=1S/C15H22N2O4S/c1-13-11-17(22(18,19)16-7-9-20-10-8-16)12-15(21-13)14-5-3-2-4-6-14/h2-6,13,15H,7-12H2,1H3/t13-,15+/m1/s1.
What are the key properties of (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine?
(2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine has a molecular weight of 326.42 g/mol, XLogP of 1.03, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-2-methyl-4-morpholin-4-ylsulfonyl-6-phenylmorpholine is sourced from PubChem (CID 98786694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).