(3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide

C19H35N3O4S — CID 97348282

IUPAC(3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide
SMILESCC(C)(CNS(=O)(=O)[C@@H]1CCCN(C(=O)C2CCCC2)C1)N1CCOCC1
InChIInChI=1S/C19H35N3O4S/c1-19(2,22-10-12-26-13-11-22)15-20-27(24,25)17-8-5-9-21(14-17)18(23)16-6-3-4-7-16/h16-17,20H,3-15H2,1-2H3/t17-/m1/s1
InChIKeyQABSTZJXOJLCCY-QGZVFWFLSA-N
MW401.57 g/mol
LogP1.20
Rot. Bonds6

About (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide

(3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide (PubChem CID 97348282) has the molecular formula C19H35N3O4S and a molecular weight of 401.57 g/mol. Its IUPAC name is (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name(3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide
PubChem CID97348282
Molecular FormulaC19H35N3O4S
Molecular Weight401.57 g/mol
Exact Mass401.23
IUPAC Name(3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide
SMILESCC(C)(CNS(=O)(=O)[C@@H]1CCCN(C(=O)C2CCCC2)C1)N1CCOCC1
InChIInChI=1S/C19H35N3O4S/c1-19(2,22-10-12-26-13-11-22)15-20-27(24,25)17-8-5-9-21(14-17)18(23)16-6-3-4-7-16/h16-17,20H,3-15H2,1-2H3/t17-/m1/s1
InChIKeyQABSTZJXOJLCCY-QGZVFWFLSA-N
XLogP1.20
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500401.57
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide with MolForge

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Related Compounds

N-(2-methyl-2-morpholin-4-ylpropyl)-4-(pyrrolidine-1-carbonyl)piperidine-1-carboxamide
CID 86999608
1-(cyclopentanecarbonyl)-N-[(2R)-2-(ethylamino)propyl]piperidine-3-sulfonamide;hydrochloride
CID 120875867
2-[[[1-(cyclopentanecarbonyl)piperidin-3-yl]sulfonylamino]methyl]-4-methylpentanoic acid
CID 120660428
1-(cyclopentanecarbonyl)piperidine-3-sulfonyl chloride
CID 75480497
(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide
CID 97348314
(3R)-1-(cyclopentanecarbonyl)-N-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]piperidine-3-sulfonamide
CID 97348626
(3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide
CID 97348332
N-tert-butyl-2-[[(3S)-1-(cyclopentanecarbonyl)piperidin-3-yl]sulfonyl-methylamino]acetamide
CID 97348337
(3S)-1-(cyclopentanecarbonyl)-N-[(2-methoxy-4-pyridinyl)methyl]piperidine-3-sulfonamide
CID 97348373
(3R)-1-(cyclopentanecarbonyl)-N-[(3-fluoro-2-pyridinyl)methyl]piperidine-3-sulfonamide
CID 97348660
1-[2-[4-(cyclobutanecarbonyl)piperazin-1-yl]ethyl]-2-methyl-3-(2-methyl-2-morpholin-4-ylpropyl)guanidine
CID 111566967
(3S)-N-cyclopentyl-1-[1-(2-methylpropyl)piperidine-4-carbonyl]piperidine-3-sulfonamide
CID 97348596

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide?
The IUPAC name of (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide (CID 97348282) is (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide.
What is the SMILES notation for (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide?
The canonical SMILES for (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide is CC(C)(CNS(=O)(=O)[C@@H]1CCCN(C(=O)C2CCCC2)C1)N1CCOCC1.
What is the InChIKey of (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide?
The InChIKey is QABSTZJXOJLCCY-QGZVFWFLSA-N. The full InChI is InChI=1S/C19H35N3O4S/c1-19(2,22-10-12-26-13-11-22)15-20-27(24,25)17-8-5-9-21(14-17)18(23)16-6-3-4-7-16/h16-17,20H,3-15H2,1-2H3/t17-/m1/s1.
What are the key properties of (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide?
(3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide has a molecular weight of 401.57 g/mol, XLogP of 1.20, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide is sourced from PubChem (CID 97348282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).