(2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid

C11H20N2O5S — CID 55150411

IUPAC(2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid
SMILESCC1CN(S(=O)(=O)N2CCC[C@@H]2C(=O)O)CC(C)O1
InChIInChI=1S/C11H20N2O5S/c1-8-6-12(7-9(2)18-8)19(16,17)13-5-3-4-10(13)11(14)15/h8-10H,3-7H2,1-2H3,(H,14,15)/t8?,9?,10-/m1/s1
InChIKeyMIHFOBQISFKDAR-UDNWOFFPSA-N
MW292.36 g/mol
LogP-0.11
Rot. Bonds3

About (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid

(2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid (PubChem CID 55150411) has the molecular formula C11H20N2O5S and a molecular weight of 292.36 g/mol. Its IUPAC name is (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid
PubChem CID55150411
Molecular FormulaC11H20N2O5S
Molecular Weight292.36 g/mol
Exact Mass292.11
IUPAC Name(2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid
SMILESCC1CN(S(=O)(=O)N2CCC[C@@H]2C(=O)O)CC(C)O1
InChIInChI=1S/C11H20N2O5S/c1-8-6-12(7-9(2)18-8)19(16,17)13-5-3-4-10(13)11(14)15/h8-10H,3-7H2,1-2H3,(H,14,15)/t8?,9?,10-/m1/s1
InChIKeyMIHFOBQISFKDAR-UDNWOFFPSA-N
XLogP-0.11
TPSA87.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.36
LogP ≤ 5-0.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl (2R)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpyrrolidine-2-carboxylate
CID 95789114
4-(2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridin-1-ylsulfonyl)-2,6-dimethylmorpholine
CID 102680815
(2S)-1-(4-methylpiperidin-1-yl)sulfonylpiperidine-2-carboxylic acid
CID 28784096
benzyl 1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonylpiperidine-2-carboxylate
CID 70127873
1-(2-methylpiperidin-1-yl)sulfonylpyrrolidine-2-carboxylic acid
CID 43210782
1-(2-methylpiperidin-1-yl)sulfonylpiperidine-2-carboxylic acid
CID 43210809
methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylmorpholine-3-carboxylate
CID 115672140
1-(2-ethylmorpholin-4-yl)sulfonylpiperidine-2-carboxylic acid
CID 60858772
4-(2,3-dimethylpiperazin-1-yl)sulfonyl-2,6-dimethylmorpholine
CID 120725700
1-(2,6-dimethylmorpholin-4-yl)sulfonyl-5-methylpiperidine-3-carboxylic acid
CID 122105624
1-[(1,1-dioxo-1,4-thiazinan-4-yl)sulfonyl]piperidine-2-carboxylic acid
CID 60858778
(3R,6R)-1-[(2R,6S)-2,6-dimethylmorpholin-4-yl]sulfonyl-6-methylpiperidine-3-carboxamide
CID 95579009

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid?
The IUPAC name of (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid (CID 55150411) is (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid.
What is the SMILES notation for (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid?
The canonical SMILES for (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid is CC1CN(S(=O)(=O)N2CCC[C@@H]2C(=O)O)CC(C)O1.
What is the InChIKey of (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid?
The InChIKey is MIHFOBQISFKDAR-UDNWOFFPSA-N. The full InChI is InChI=1S/C11H20N2O5S/c1-8-6-12(7-9(2)18-8)19(16,17)13-5-3-4-10(13)11(14)15/h8-10H,3-7H2,1-2H3,(H,14,15)/t8?,9?,10-/m1/s1.
What are the key properties of (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid?
(2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid has a molecular weight of 292.36 g/mol, XLogP of -0.11, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(2,6-dimethylmorpholin-4-yl)sulfonylpyrrolidine-2-carboxylic acid is sourced from PubChem (CID 55150411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).