1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine

C11H21NO2S — CID 121183164

IUPAC1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine
SMILESCS(=O)(=O)C1CCN(CC2CCCC2)C1
InChIInChI=1S/C11H21NO2S/c1-15(13,14)11-6-7-12(9-11)8-10-4-2-3-5-10/h10-11H,2-9H2,1H3
InChIKeyYSWNUVKQOBWTCG-UHFFFAOYSA-N
MW231.36 g/mol
LogP1.30
Rot. Bonds3

About 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine

1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine (PubChem CID 121183164) has the molecular formula C11H21NO2S and a molecular weight of 231.36 g/mol. Its IUPAC name is 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine.

Molecular Properties

Compound Name1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine
PubChem CID121183164
Molecular FormulaC11H21NO2S
Molecular Weight231.36 g/mol
Exact Mass231.13
IUPAC Name1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine
SMILESCS(=O)(=O)C1CCN(CC2CCCC2)C1
InChIInChI=1S/C11H21NO2S/c1-15(13,14)11-6-7-12(9-11)8-10-4-2-3-5-10/h10-11H,2-9H2,1H3
InChIKeyYSWNUVKQOBWTCG-UHFFFAOYSA-N
XLogP1.30
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.36
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cycloheptylmethyl)-4-(2-methylsulfonylethyl)piperazine
CID 75507205
(2R)-1-(3-methylsulfonylpiperidin-1-yl)propan-2-amine
CID 130715172
1-[(3aS,8aR)-6-(cyclopentylmethyl)-1,3,3a,4,5,7,8,8a-octahydropyrrolo[3,4-d]azepin-2-yl]-3-methylsulfonylpropan-1-one
CID 155877701
1-(cyclopentylmethyl)pyrrolidin-3-ol
CID 62916815
2-cyclohexyl-1-(3-methylsulfonylpyrrolidin-1-yl)ethanone
CID 90584553
(3R)-1-(cyclopentylmethyl)-3-methoxypyrrolidine
CID 126986050
1-(cyclopropylmethyl)-3-methylpyrrolidine
CID 66698418
2-methyl-1-(3-methylsulfonylazepan-1-yl)propan-2-amine;hydrochloride
CID 120858030
N-[1-(cyclopentylmethyl)piperidin-4-yl]cyclopropanesulfonamide
CID 154575693
1-(cyclohexylmethyl)-3-(2,2-dimethylpropyl)pyrrolidine
CID 70936687
(3S)-1-[(1-methylsulfonylpiperidin-3-yl)methyl]pyrrolidin-3-ol
CID 113249309
3-methylsulfonylpyrrolidine-1-sulfonamide
CID 57434350

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine?
The IUPAC name of 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine (CID 121183164) is 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine.
What is the SMILES notation for 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine?
The canonical SMILES for 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine is CS(=O)(=O)C1CCN(CC2CCCC2)C1.
What is the InChIKey of 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine?
The InChIKey is YSWNUVKQOBWTCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2S/c1-15(13,14)11-6-7-12(9-11)8-10-4-2-3-5-10/h10-11H,2-9H2,1H3.
What are the key properties of 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine?
1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine has a molecular weight of 231.36 g/mol, XLogP of 1.30, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylmethyl)-3-methylsulfonylpyrrolidine is sourced from PubChem (CID 121183164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).