N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide

C10H21N3O2S — CID 114696701

IUPACN-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide
SMILESCC1(NS(=O)(=O)N2CCCC2)CCNCC1
InChIInChI=1S/C10H21N3O2S/c1-10(4-6-11-7-5-10)12-16(14,15)13-8-2-3-9-13/h11-12H,2-9H2,1H3
InChIKeyKMWUWYCPOLTOCR-UHFFFAOYSA-N
MW247.36 g/mol
LogP0.06
Rot. Bonds3

About N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide

N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide (PubChem CID 114696701) has the molecular formula C10H21N3O2S and a molecular weight of 247.36 g/mol. Its IUPAC name is N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide.

Molecular Properties

Compound NameN-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide
PubChem CID114696701
Molecular FormulaC10H21N3O2S
Molecular Weight247.36 g/mol
Exact Mass247.14
IUPAC NameN-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide
SMILESCC1(NS(=O)(=O)N2CCCC2)CCNCC1
InChIInChI=1S/C10H21N3O2S/c1-10(4-6-11-7-5-10)12-16(14,15)13-8-2-3-9-13/h11-12H,2-9H2,1H3
InChIKeyKMWUWYCPOLTOCR-UHFFFAOYSA-N
XLogP0.06
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 50.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-Methyl-4-(pyrrolidin-1-yl)piperidine
CID 59352900
4-Ethyl-4-(pyrrolidin-1-yl)piperidine
CID 125449109
N-(2-amino-2-ethylbutyl)piperidine-1-sulfonamide
CID 91645913
(S)-5-ethyl-2,5-dimethyl-1,2,6-thiadiazinane 1,1-dioxide
CID 138857821
4-methyl-N-(2,2,2-trifluoroethylsulfamoyl)piperidin-4-amine
CID 113637472
4-methyl-4-(methylamino)-N-(2,2,2-trifluoroethyl)piperidine-1-sulfonamide
CID 114811228
2-(Piperidin-4-ylmethyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 20434881
2-[2-(4-Piperidyl)ethyl]-4-methyl-1,2,5-thiadiazolidine-1,1-dioxide
CID 20434886
2-[2-(4-Piperidyl)ethyl]-3-methyl-1,2,5-thiadiazolidine-1,1-dioxide
CID 20434889
2-(2-Piperidin-4-ylethyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 20434919
2-(1-Piperidin-4-ylethyl)-1,2,5-thiadiazolidine 1,1-dioxide
CID 20434925
2lambda6-Thia-1,3,8-triazaspiro[4.5]decane 2,2-dioxide
CID 59929932

Frequently Asked Questions

What is the IUPAC name of N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide?
The IUPAC name of N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide (CID 114696701) is N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide.
What is the SMILES notation for N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide?
The canonical SMILES for N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide is CC1(NS(=O)(=O)N2CCCC2)CCNCC1.
What is the InChIKey of N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide?
The InChIKey is KMWUWYCPOLTOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O2S/c1-10(4-6-11-7-5-10)12-16(14,15)13-8-2-3-9-13/h11-12H,2-9H2,1H3.
What are the key properties of N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide?
N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide has a molecular weight of 247.36 g/mol, XLogP of 0.06, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylpiperidin-4-yl)pyrrolidine-1-sulfonamide is sourced from PubChem (CID 114696701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).