1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide

C14H28N2O2S — CID 119052640

IUPAC1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide
SMILESCC1(C)CCCNC1CNS(=O)(=O)CC1CCCC1
InChIInChI=1S/C14H28N2O2S/c1-14(2)8-5-9-15-13(14)10-16-19(17,18)11-12-6-3-4-7-12/h12-13,15-16H,3-11H2,1-2H3
InChIKeyBDEFGTXKYJATTH-UHFFFAOYSA-N
MW288.46 g/mol
LogP1.87
Rot. Bonds5

About 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide

1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide (PubChem CID 119052640) has the molecular formula C14H28N2O2S and a molecular weight of 288.46 g/mol. Its IUPAC name is 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide
PubChem CID119052640
Molecular FormulaC14H28N2O2S
Molecular Weight288.46 g/mol
Exact Mass288.19
IUPAC Name1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide
SMILESCC1(C)CCCNC1CNS(=O)(=O)CC1CCCC1
InChIInChI=1S/C14H28N2O2S/c1-14(2)8-5-9-15-13(14)10-16-19(17,18)11-12-6-3-4-7-12/h12-13,15-16H,3-11H2,1-2H3
InChIKeyBDEFGTXKYJATTH-UHFFFAOYSA-N
XLogP1.87
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3,3-dimethylpiperidin-2-yl)methyl]pyrrolidine-1-sulfonamide
CID 114083940
1-cyclopentyl-N-[[(2R)-pyrrolidin-2-yl]methyl]methanesulfonamide
CID 121497367
1-cyano-N-[(3,3-dimethylpiperidin-2-yl)methyl]propane-1-sulfonamide
CID 114083935
1-cyclohexyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide;hydrochloride
CID 119974331
1-(3-cyanophenyl)-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide
CID 120666430
1-cyclopentyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride
CID 120876267
1-cyclohexyl-N-[(3-ethylpiperidin-2-yl)methyl]methanesulfonamide
CID 82734539
N-[(3,3-dimethylpiperidin-2-yl)methyl]-2,3,4-trifluorobenzenesulfonamide
CID 120714107
N-[4-[(3,3-dimethylpiperidin-2-yl)methylsulfamoyl]phenyl]acetamide
CID 120666406
N-[(3,3-dimethylpiperidin-2-yl)methyl]-1,3,5-trimethylpyrazole-4-sulfonamide;hydrochloride
CID 120666378
N-[(3,3-dimethylpiperidin-2-yl)methyl]-1-methylcyclopropane-1-carboxamide
CID 120670741
N-[(3,3-dimethylpiperidin-2-yl)methyl]-2-fluoro-4,5-dimethoxybenzenesulfonamide
CID 120666342

Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide?
The IUPAC name of 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide (CID 119052640) is 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide.
What is the SMILES notation for 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide?
The canonical SMILES for 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide is CC1(C)CCCNC1CNS(=O)(=O)CC1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide?
The InChIKey is BDEFGTXKYJATTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2S/c1-14(2)8-5-9-15-13(14)10-16-19(17,18)11-12-6-3-4-7-12/h12-13,15-16H,3-11H2,1-2H3.
What are the key properties of 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide?
1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide has a molecular weight of 288.46 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[(3,3-dimethylpiperidin-2-yl)methyl]methanesulfonamide is sourced from PubChem (CID 119052640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).