(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide

C14H26N2O3S — CID 97348594

IUPAC(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide
SMILESCC(C)C(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C14H26N2O3S/c1-11(2)14(17)16-9-5-8-13(10-16)20(18,19)15-12-6-3-4-7-12/h11-13,15H,3-10H2,1-2H3/t13-/m0/s1
InChIKeyQTPPTVZVSKXMJW-ZDUSSCGKSA-N
MW302.44 g/mol
LogP1.50
Rot. Bonds4

About (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide

(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide (PubChem CID 97348594) has the molecular formula C14H26N2O3S and a molecular weight of 302.44 g/mol. Its IUPAC name is (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide.

Molecular Properties

Compound Name(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide
PubChem CID97348594
Molecular FormulaC14H26N2O3S
Molecular Weight302.44 g/mol
Exact Mass302.17
IUPAC Name(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide
SMILESCC(C)C(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1
InChIInChI=1S/C14H26N2O3S/c1-11(2)14(17)16-9-5-8-13(10-16)20(18,19)15-12-6-3-4-7-12/h11-13,15H,3-10H2,1-2H3/t13-/m0/s1
InChIKeyQTPPTVZVSKXMJW-ZDUSSCGKSA-N
XLogP1.50
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.44
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-N-cyclopentyl-1-(2,2-dimethylpropanoyl)piperidine-3-sulfonamide
CID 97348527
(3S)-N-cyclopentyl-1-[1-(2-methylpropyl)piperidine-4-carbonyl]piperidine-3-sulfonamide
CID 97348596
N-cyclopentyl-1-[2-(2-oxopyrrolidin-1-yl)butanoyl]piperidine-3-sulfonamide
CID 127802994
(3R)-N-cyclopentyl-1-(morpholine-4-carbonyl)piperidine-3-sulfonamide
CID 97348314
4-[3-(cyclopentylsulfamoyl)piperidin-1-yl]-4-oxobutanoic acid
CID 120551607
(3R)-3-(dimethylsulfamoylamino)-1-(2-methylpropanoyl)piperidine
CID 125447905
cis-(1R,2S)-2-[(3S)-3-(cyclopentylsulfamoyl)piperidine-1-carbonyl]cyclopropane-1-carboxylic acid
CID 125120065
(3R)-N-cyclopentyl-1-methylsulfonylpiperidine-3-sulfonamide
CID 97348297
(3R)-N-ethyl-1-(2-methylpropanoyl)pyrrolidine-3-sulfonamide
CID 97158472
1-[2-(2-chlorophenyl)acetyl]-N-cyclopentylpiperidine-3-sulfonamide
CID 126767287
2-[[(cyclopentylamino)-[3-(cyclopentylsulfamoyl)piperidin-1-yl]methylidene]amino]-N,N-dimethylacetamide
CID 110050010
1-(3-cyclohexylsulfonylazetidin-1-yl)-2-methylpropan-1-one
CID 90593934

Frequently Asked Questions

What is the IUPAC name of (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide?
The IUPAC name of (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide (CID 97348594) is (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide.
What is the SMILES notation for (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide?
The canonical SMILES for (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide is CC(C)C(=O)N1CCC[C@H](S(=O)(=O)NC2CCCC2)C1.
What is the InChIKey of (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide?
The InChIKey is QTPPTVZVSKXMJW-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H26N2O3S/c1-11(2)14(17)16-9-5-8-13(10-16)20(18,19)15-12-6-3-4-7-12/h11-13,15H,3-10H2,1-2H3/t13-/m0/s1.
What are the key properties of (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide?
(3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide has a molecular weight of 302.44 g/mol, XLogP of 1.50, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-N-cyclopentyl-1-(2-methylpropanoyl)piperidine-3-sulfonamide is sourced from PubChem (CID 97348594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).