(2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide

C11H23N3O3S — CID 124777060

IUPAC(2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide
SMILESC[C@@H]1CN(S(=O)(=O)N(C)[C@H]2CCNC2)C[C@@H](C)O1
InChIInChI=1S/C11H23N3O3S/c1-9-7-14(8-10(2)17-9)18(15,16)13(3)11-4-5-12-6-11/h9-12H,4-8H2,1-3H3/t9-,10-,11+/m1/s1
InChIKeyMFZZFSLGMHAKAO-MXWKQRLJSA-N
MW277.39 g/mol
LogP-0.37
Rot. Bonds3

About (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide

(2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide (PubChem CID 124777060) has the molecular formula C11H23N3O3S and a molecular weight of 277.39 g/mol. Its IUPAC name is (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide.

Molecular Properties

Compound Name(2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide
PubChem CID124777060
Molecular FormulaC11H23N3O3S
Molecular Weight277.39 g/mol
Exact Mass277.15
IUPAC Name(2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide
SMILESC[C@@H]1CN(S(=O)(=O)N(C)[C@H]2CCNC2)C[C@@H](C)O1
InChIInChI=1S/C11H23N3O3S/c1-9-7-14(8-10(2)17-9)18(15,16)13(3)11-4-5-12-6-11/h9-12H,4-8H2,1-3H3/t9-,10-,11+/m1/s1
InChIKeyMFZZFSLGMHAKAO-MXWKQRLJSA-N
XLogP-0.37
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide?
The IUPAC name of (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide (CID 124777060) is (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide.
What is the SMILES notation for (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide?
The canonical SMILES for (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide is C[C@@H]1CN(S(=O)(=O)N(C)[C@H]2CCNC2)C[C@@H](C)O1.
What is the InChIKey of (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide?
The InChIKey is MFZZFSLGMHAKAO-MXWKQRLJSA-N. The full InChI is InChI=1S/C11H23N3O3S/c1-9-7-14(8-10(2)17-9)18(15,16)13(3)11-4-5-12-6-11/h9-12H,4-8H2,1-3H3/t9-,10-,11+/m1/s1.
What are the key properties of (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide?
(2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide has a molecular weight of 277.39 g/mol, XLogP of -0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-N,2,6-trimethyl-N-[(3S)-pyrrolidin-3-yl]morpholine-4-sulfonamide is sourced from PubChem (CID 124777060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).