N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide

C13H23N3O3S — CID 47149015

IUPACN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide
SMILESCN(C)C(CNS(=O)(=O)N1CCCCC1)c1ccco1
InChIInChI=1S/C13H23N3O3S/c1-15(2)12(13-7-6-10-19-13)11-14-20(17,18)16-8-4-3-5-9-16/h6-7,10,12,14H,3-5,8-9,11H2,1-2H3
InChIKeyURHXZHOBSYBWCA-UHFFFAOYSA-N
MW301.41 g/mol
LogP1.20
Rot. Bonds6

About N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide (PubChem CID 47149015) has the molecular formula C13H23N3O3S and a molecular weight of 301.41 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide
PubChem CID47149015
Molecular FormulaC13H23N3O3S
Molecular Weight301.41 g/mol
Exact Mass301.15
IUPAC NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide
SMILESCN(C)C(CNS(=O)(=O)N1CCCCC1)c1ccco1
InChIInChI=1S/C13H23N3O3S/c1-15(2)12(13-7-6-10-19-13)11-14-20(17,18)16-8-4-3-5-9-16/h6-7,10,12,14H,3-5,8-9,11H2,1-2H3
InChIKeyURHXZHOBSYBWCA-UHFFFAOYSA-N
XLogP1.20
TPSA65.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]piperidine-1-sulfonamide
CID 51076118
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-piperidin-1-ylsulfonylbenzamide
CID 55332159
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzenesulfonamide
CID 45003113
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]pyrrolidine-1-carboxamide
CID 122566101
N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-2,6-dimethylmorpholine-4-sulfonamide
CID 51330775
1-(4-chlorophenyl)-N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]methanesulfonamide
CID 93157738
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(1-methyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)propanamide
CID 43005077
3-N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzene-1,3-disulfonamide
CID 55511765
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-nitrobenzenesulfonamide
CID 41454933
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 60700187
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-3,5-dimethyl-1,2-oxazole-4-sulfonamide
CID 51710552
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-1-[4-(trifluoromethyl)phenyl]methanesulfonamide
CID 71796438

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide?
The IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide (CID 47149015) is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide?
The canonical SMILES for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide is CN(C)C(CNS(=O)(=O)N1CCCCC1)c1ccco1.
What is the InChIKey of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide?
The InChIKey is URHXZHOBSYBWCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O3S/c1-15(2)12(13-7-6-10-19-13)11-14-20(17,18)16-8-4-3-5-9-16/h6-7,10,12,14H,3-5,8-9,11H2,1-2H3.
What are the key properties of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide?
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide has a molecular weight of 301.41 g/mol, XLogP of 1.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]piperidine-1-sulfonamide is sourced from PubChem (CID 47149015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).