[(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine

C6H14N2O2S — CID 71757008

IUPAC[(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine
SMILESCS(=O)(=O)N1CCC[C@@H]1CN
InChIInChI=1S/C6H14N2O2S/c1-11(9,10)8-4-2-3-6(8)5-7/h6H,2-5,7H2,1H3/t6-/m1/s1
InChIKeyRYZYXPKYSJEBDD-ZCFIWIBFSA-N
MW178.26 g/mol
LogP-0.63
Rot. Bonds2

About [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine

[(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine (PubChem CID 71757008) has the molecular formula C6H14N2O2S and a molecular weight of 178.26 g/mol. Its IUPAC name is [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine.

Molecular Properties

Compound Name[(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine
PubChem CID71757008
Molecular FormulaC6H14N2O2S
Molecular Weight178.26 g/mol
Exact Mass178.08
IUPAC Name[(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine
SMILESCS(=O)(=O)N1CCC[C@@H]1CN
InChIInChI=1S/C6H14N2O2S/c1-11(9,10)8-4-2-3-6(8)5-7/h6H,2-5,7H2,1H3/t6-/m1/s1
InChIKeyRYZYXPKYSJEBDD-ZCFIWIBFSA-N
XLogP-0.63
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.26
LogP ≤ 5-0.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2S)-2-Pyrrolidinylmethyl]-trifluoromethanesulfonamide
CID 11368252
(R)-1,1,1-Trifluoro-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 70700475
1-(Methanesulfonyl)-3-aminopiperidine
CID 19623288
N-(piperidin-3-yl)methanesulfonamide
CID 20113226
1-Methanesulfonylpiperidin-3-amine hydrochloride
CID 45792405
[(2S)-pyrrolidin-2-yl]methanesulfonamide
CID 52326752
N-(pyrrolidin-3-yl)methanesulfonamide hydrochloride
CID 54593949
N-[(3S)-pyrrolidin-3-yl]methanesulfonamide hydrochloride
CID 67249206
N-((3R)-pyrrolidin-3-yl)methanesulfonamide hydrochloride
CID 137965899
1,1,1-Trifluoro-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 53412406
N-(Pyrrolidin-3-yl)methanesulfonamide
CID 22352625
3-Amino-1-methanesulfonylpyrrolidine
CID 53393253

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine?
The IUPAC name of [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine (CID 71757008) is [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine.
What is the SMILES notation for [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine?
The canonical SMILES for [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine is CS(=O)(=O)N1CCC[C@@H]1CN.
What is the InChIKey of [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine?
The InChIKey is RYZYXPKYSJEBDD-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H14N2O2S/c1-11(9,10)8-4-2-3-6(8)5-7/h6H,2-5,7H2,1H3/t6-/m1/s1.
What are the key properties of [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine?
[(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine has a molecular weight of 178.26 g/mol, XLogP of -0.63, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-methylsulfonylpyrrolidin-2-yl]methanamine is sourced from PubChem (CID 71757008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).