(3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide

C15H28N2O3S — CID 97348527

IUPAC(3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide
SMILESCC(C)(C)C(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C15H28N2O3S/c1-15(2,3)14(18)17-10-6-9-13(11-17)21(19,20)16-12-7-4-5-8-12/h12-13,16H,4-11H2,1-3H3/t13-/m1/s1
InChIKeyJVANRHZJBBJSJZ-CYBMUJFWSA-N
MW316.47 g/mol
LogP1.89
Rot. Bonds3

About (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide

(3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide (PubChem CID 97348527) has the molecular formula C15H28N2O3S and a molecular weight of 316.47 g/mol. Its IUPAC name is (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name(3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide
PubChem CID97348527
Molecular FormulaC15H28N2O3S
Molecular Weight316.47 g/mol
Exact Mass316.18
IUPAC Name(3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide
SMILESCC(C)(C)C(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C15H28N2O3S/c1-15(2,3)14(18)17-10-6-9-13(11-17)21(19,20)16-12-7-4-5-8-12/h12-13,16H,4-11H2,1-3H3/t13-/m1/s1
InChIKeyJVANRHZJBBJSJZ-CYBMUJFWSA-N
XLogP1.89
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.47
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide?
The IUPAC name of (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide (CID 97348527) is (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide.
What is the SMILES notation for (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide?
The canonical SMILES for (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide is CC(C)(C)C(=O)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1.
What is the InChIKey of (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide?
The InChIKey is JVANRHZJBBJSJZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H28N2O3S/c1-15(2,3)14(18)17-10-6-9-13(11-17)21(19,20)16-12-7-4-5-8-12/h12-13,16H,4-11H2,1-3H3/t13-/m1/s1.
What are the key properties of (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide?
(3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide has a molecular weight of 316.47 g/mol, XLogP of 1.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide is sourced from PubChem (CID 97348527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).