(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide

C15H27N3O4S — CID 97348314

IUPAC(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide
SMILESO=C(N1CCOCC1)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C15H27N3O4S/c19-15(17-8-10-22-11-9-17)18-7-3-6-14(12-18)23(20,21)16-13-4-1-2-5-13/h13-14,16H,1-12H2/t14-/m1/s1
InChIKeyIOKFDJSKDXROEB-CQSZACIVSA-N
MW345.47 g/mol
LogP0.76
Rot. Bonds3

About (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide

(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide (PubChem CID 97348314) has the molecular formula C15H27N3O4S and a molecular weight of 345.47 g/mol. Its IUPAC name is (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide
PubChem CID97348314
Molecular FormulaC15H27N3O4S
Molecular Weight345.47 g/mol
Exact Mass345.17
IUPAC Name(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide
SMILESO=C(N1CCOCC1)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C15H27N3O4S/c19-15(17-8-10-22-11-9-17)18-7-3-6-14(12-18)23(20,21)16-13-4-1-2-5-13/h13-14,16H,1-12H2/t14-/m1/s1
InChIKeyIOKFDJSKDXROEB-CQSZACIVSA-N
XLogP0.76
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.47
LogP ≤ 50.76
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-(morpholine-4-carbonyl)piperidine-3-sulfonamide?
The IUPAC name of (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide (CID 97348314) is (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide.
What is the SMILES notation for (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide?
The canonical SMILES for (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide is O=C(N1CCOCC1)N1CCC[C@@H](S(=O)(=O)NC2CCCC2)C1.
What is the InChIKey of (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide?
The InChIKey is IOKFDJSKDXROEB-CQSZACIVSA-N. The full InChI is InChI=1S/C15H27N3O4S/c19-15(17-8-10-22-11-9-17)18-7-3-6-14(12-18)23(20,21)16-13-4-1-2-5-13/h13-14,16H,1-12H2/t14-/m1/s1.
What are the key properties of (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide?
(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide has a molecular weight of 345.47 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide is sourced from PubChem (CID 97348314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).