N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide

C13H26N2O3S — CID 103836020

IUPACN-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide
SMILESCC1CC(C)CN(S(=O)(=O)NC2CCCC2CO)C1
InChIInChI=1S/C13H26N2O3S/c1-10-6-11(2)8-15(7-10)19(17,18)14-13-5-3-4-12(13)9-16/h10-14,16H,3-9H2,1-2H3
InChIKeyKQILYQRGTHASLN-UHFFFAOYSA-N
MW290.43 g/mol
LogP0.96
Rot. Bonds4

About N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide

N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide (PubChem CID 103836020) has the molecular formula C13H26N2O3S and a molecular weight of 290.43 g/mol. Its IUPAC name is N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide
PubChem CID103836020
Molecular FormulaC13H26N2O3S
Molecular Weight290.43 g/mol
Exact Mass290.17
IUPAC NameN-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide
SMILESCC1CC(C)CN(S(=O)(=O)NC2CCCC2CO)C1
InChIInChI=1S/C13H26N2O3S/c1-10-6-11(2)8-15(7-10)19(17,18)14-13-5-3-4-12(13)9-16/h10-14,16H,3-9H2,1-2H3
InChIKeyKQILYQRGTHASLN-UHFFFAOYSA-N
XLogP0.96
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.43
LogP ≤ 50.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[2-(hydroxymethyl)cyclopentyl]sulfamoyl]piperidine-3-carboxylic acid
CID 106359331
N-[2-(hydroxymethyl)cyclopentyl]methanesulfonamide
CID 103697796
1-[[2-(hydroxymethyl)cyclohexyl]sulfamoyl]piperidine-4-carboxylic acid
CID 106359363
N-[2-(chloromethyl)cyclohexyl]-3-methylpiperidine-1-sulfonamide
CID 106367836
N-[2-(bromomethyl)cyclohexyl]-3-methylpiperidine-1-sulfonamide
CID 114179805
N-[2-(aminomethyl)cyclopentyl]-2,6-dimethylmorpholine-4-sulfonamide;hydrochloride
CID 119985507
N-[2-(hydroxymethyl)cyclopentyl]cyclopropanesulfonamide
CID 103835909
3,5-dimethyl-N-(4-methylcyclohexyl)piperidine-1-sulfonamide
CID 134062148
N-[(1S,2S)-2-(hydroxymethyl)cyclohexyl]ethanesulfonamide
CID 86708972
N-cyclobutyl-N-(2-hydroxyethyl)-3,5-dimethylpiperidine-1-sulfonamide
CID 102675737
[2-(propylsulfamoylamino)cyclopentyl]methanol
CID 106364586
3,5-dimethyl-N-propylpiperidine-1-sulfonamide
CID 43243297

Frequently Asked Questions

What is the IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide?
The IUPAC name of N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide (CID 103836020) is N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide.
What is the SMILES notation for N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide?
The canonical SMILES for N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide is CC1CC(C)CN(S(=O)(=O)NC2CCCC2CO)C1.
What is the InChIKey of N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide?
The InChIKey is KQILYQRGTHASLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O3S/c1-10-6-11(2)8-15(7-10)19(17,18)14-13-5-3-4-12(13)9-16/h10-14,16H,3-9H2,1-2H3.
What are the key properties of N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide?
N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide has a molecular weight of 290.43 g/mol, XLogP of 0.96, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(hydroxymethyl)cyclopentyl]-3,5-dimethylpiperidine-1-sulfonamide is sourced from PubChem (CID 103836020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).