1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide

C13H26N2O3S — CID 99827262

IUPAC1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide
SMILESC[C@H](CN1CCCCC1)NS(=O)(=O)C[C@@H]1CCCO1
InChIInChI=1S/C13H26N2O3S/c1-12(10-15-7-3-2-4-8-15)14-19(16,17)11-13-6-5-9-18-13/h12-14H,2-11H2,1H3/t12-,13+/m1/s1
InChIKeyGFEDJKHVZJSPQZ-OLZOCXBDSA-N
MW290.43 g/mol
LogP0.96
Rot. Bonds6

About 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide

1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide (PubChem CID 99827262) has the molecular formula C13H26N2O3S and a molecular weight of 290.43 g/mol. Its IUPAC name is 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide.

Molecular Properties

Compound Name1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide
PubChem CID99827262
Molecular FormulaC13H26N2O3S
Molecular Weight290.43 g/mol
Exact Mass290.17
IUPAC Name1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide
SMILESC[C@H](CN1CCCCC1)NS(=O)(=O)C[C@@H]1CCCO1
InChIInChI=1S/C13H26N2O3S/c1-12(10-15-7-3-2-4-8-15)14-19(16,17)11-13-6-5-9-18-13/h12-14H,2-11H2,1H3/t12-,13+/m1/s1
InChIKeyGFEDJKHVZJSPQZ-OLZOCXBDSA-N
XLogP0.96
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide with MolForge

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Related Compounds

N-(4-aminobutan-2-yl)-1-(oxolan-2-yl)methanesulfonamide
CID 63246921
N-[(2R)-1-[(3R)-3-methylpiperidin-1-yl]propan-2-yl]-2-[(2S)-oxolan-2-yl]ethanesulfonamide
CID 99827324
N-(1-piperidin-1-ylpropan-2-yl)ethanesulfonamide
CID 64584940
3-(oxolan-2-ylmethylsulfonylamino)butanethioamide
CID 63246950
(2R)-2-(oxolan-2-ylmethylsulfonylamino)propanoic acid
CID 78927442
N-(3-oxobutan-2-yl)-1-(oxolan-2-yl)methanesulfonamide
CID 64994230
N-(3-chloro-2-methylpropyl)-1-(oxolan-2-yl)methanesulfonamide
CID 65037518
N-[(2R)-1-piperidin-1-ylpropan-2-yl]cyclopropanesulfonamide
CID 99827272
1-(oxolan-2-ylmethoxy)-3-(1-piperidin-1-ylpropan-2-ylamino)propan-2-ol
CID 61499940
(2R)-3-methyl-2-(oxolan-2-ylmethylsulfonylamino)butanoic acid
CID 79011082
N-[3-(oxolan-2-yl)propyl]-1-pyrrolidin-1-ylpropan-2-amine
CID 65163462
N-hex-5-yn-3-yl-1-(oxolan-2-yl)methanesulfonamide
CID 115650528

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide?
The IUPAC name of 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide (CID 99827262) is 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide.
What is the SMILES notation for 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide?
The canonical SMILES for 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide is C[C@H](CN1CCCCC1)NS(=O)(=O)C[C@@H]1CCCO1.
What is the InChIKey of 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide?
The InChIKey is GFEDJKHVZJSPQZ-OLZOCXBDSA-N. The full InChI is InChI=1S/C13H26N2O3S/c1-12(10-15-7-3-2-4-8-15)14-19(16,17)11-13-6-5-9-18-13/h12-14H,2-11H2,1H3/t12-,13+/m1/s1.
What are the key properties of 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide?
1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide has a molecular weight of 290.43 g/mol, XLogP of 0.96, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-oxolan-2-yl]-N-[(2R)-1-piperidin-1-ylpropan-2-yl]methanesulfonamide is sourced from PubChem (CID 99827262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).