(3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide

C19H35N3O3S — CID 97348332

IUPAC(3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide
SMILESCCCN1CCC(NS(=O)(=O)[C@@H]2CCCN(C(=O)C3CCCC3)C2)CC1
InChIInChI=1S/C19H35N3O3S/c1-2-11-21-13-9-17(10-14-21)20-26(24,25)18-8-5-12-22(15-18)19(23)16-6-3-4-7-16/h16-18,20H,2-15H2,1H3/t18-/m1/s1
InChIKeyLMOSOHPRGVFFNN-GOSISDBHSA-N
MW385.57 g/mol
LogP1.96
Rot. Bonds6

About (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide

(3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide (PubChem CID 97348332) has the molecular formula C19H35N3O3S and a molecular weight of 385.57 g/mol. Its IUPAC name is (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name(3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide
PubChem CID97348332
Molecular FormulaC19H35N3O3S
Molecular Weight385.57 g/mol
Exact Mass385.24
IUPAC Name(3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide
SMILESCCCN1CCC(NS(=O)(=O)[C@@H]2CCCN(C(=O)C3CCCC3)C2)CC1
InChIInChI=1S/C19H35N3O3S/c1-2-11-21-13-9-17(10-14-21)20-26(24,25)18-8-5-12-22(15-18)19(23)16-6-3-4-7-16/h16-18,20H,2-15H2,1H3/t18-/m1/s1
InChIKeyLMOSOHPRGVFFNN-GOSISDBHSA-N
XLogP1.96
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.57
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3S)-N-cyclopentyl-1-[1-(2-methylpropyl)piperidine-4-carbonyl]piperidine-3-sulfonamide
CID 97348596
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
(3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide
CID 97348527
(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide
CID 97348594
cis-(1R,2S)-2-[(3S)-3-(cyclopentylsulfamoyl)piperidine-1-carbonyl]cyclopropane-1-carboxylic acid
CID 125120065
1-(cyclopentanecarbonyl)piperidine-3-sulfonyl chloride
CID 75480497
4-[3-(cyclopentylsulfamoyl)piperidin-1-yl]-4-oxobutanoic acid
CID 120551607
(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide
CID 97348314
(3R)-1-(cyclopentanecarbonyl)-N-(2-methyl-2-morpholin-4-ylpropyl)piperidine-3-sulfonamide
CID 97348282
(3S)-1-(cyclopentanecarbonyl)-N-methyl-N-(1-methylpiperidin-4-yl)piperidine-3-sulfonamide
CID 97348227
N-[1-(cyclohexanecarbonyl)piperidin-4-yl]methanesulfonamide
CID 51302071

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide?
The IUPAC name of (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide (CID 97348332) is (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide.
What is the SMILES notation for (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide?
The canonical SMILES for (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide is CCCN1CCC(NS(=O)(=O)[C@@H]2CCCN(C(=O)C3CCCC3)C2)CC1.
What is the InChIKey of (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide?
The InChIKey is LMOSOHPRGVFFNN-GOSISDBHSA-N. The full InChI is InChI=1S/C19H35N3O3S/c1-2-11-21-13-9-17(10-14-21)20-26(24,25)18-8-5-12-22(15-18)19(23)16-6-3-4-7-16/h16-18,20H,2-15H2,1H3/t18-/m1/s1.
What are the key properties of (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide?
(3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide has a molecular weight of 385.57 g/mol, XLogP of 1.96, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(cyclopentanecarbonyl)-N-(1-propylpiperidin-4-yl)piperidine-3-sulfonamide is sourced from PubChem (CID 97348332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).