(3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide

C11H22N2O4S2 — CID 97348297

IUPAC(3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide
SMILESCS(=O)(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C11H22N2O4S2/c1-18(14,15)13-8-4-7-11(9-13)19(16,17)12-10-5-2-3-6-10/h10-12H,2-9H2,1H3/t11-/m1/s1
InChIKeySPNWPHDVEHUKNM-LLVKDONJSA-N
MW310.44 g/mol
LogP0.27
Rot. Bonds4

About (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide

(3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide (PubChem CID 97348297) has the molecular formula C11H22N2O4S2 and a molecular weight of 310.44 g/mol. Its IUPAC name is (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide.

Molecular Properties

Compound Name(3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide
PubChem CID97348297
Molecular FormulaC11H22N2O4S2
Molecular Weight310.44 g/mol
Exact Mass310.10
IUPAC Name(3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide
SMILESCS(=O)(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C11H22N2O4S2/c1-18(14,15)13-8-4-7-11(9-13)19(16,17)12-10-5-2-3-6-10/h10-12H,2-9H2,1H3/t11-/m1/s1
InChIKeySPNWPHDVEHUKNM-LLVKDONJSA-N
XLogP0.27
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide?
The IUPAC name of (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide (CID 97348297) is (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide.
What is the SMILES notation for (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide?
The canonical SMILES for (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide is CS(=O)(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1.
What is the InChIKey of (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide?
The InChIKey is SPNWPHDVEHUKNM-LLVKDONJSA-N. The full InChI is InChI=1S/C11H22N2O4S2/c1-18(14,15)13-8-4-7-11(9-13)19(16,17)12-10-5-2-3-6-10/h10-12H,2-9H2,1H3/t11-/m1/s1.
What are the key properties of (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide?
(3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide has a molecular weight of 310.44 g/mol, XLogP of 0.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide is sourced from PubChem (CID 97348297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).