N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide

C11H18N2O3S — CID 54972326

IUPACN-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide
SMILESCC(NS(=O)(=O)C1CCCNC1)c1ccco1
InChIInChI=1S/C11H18N2O3S/c1-9(11-5-3-7-16-11)13-17(14,15)10-4-2-6-12-8-10/h3,5,7,9-10,12-13H,2,4,6,8H2,1H3
InChIKeyBUZGUIHDJFTHDO-UHFFFAOYSA-N
MW258.34 g/mol
LogP1.01
Rot. Bonds4

About N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide

N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide (PubChem CID 54972326) has the molecular formula C11H18N2O3S and a molecular weight of 258.34 g/mol. Its IUPAC name is N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide.

Molecular Properties

Compound NameN-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide
PubChem CID54972326
Molecular FormulaC11H18N2O3S
Molecular Weight258.34 g/mol
Exact Mass258.10
IUPAC NameN-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide
SMILESCC(NS(=O)(=O)C1CCCNC1)c1ccco1
InChIInChI=1S/C11H18N2O3S/c1-9(11-5-3-7-16-11)13-17(14,15)10-4-2-6-12-8-10/h3,5,7,9-10,12-13H,2,4,6,8H2,1H3
InChIKeyBUZGUIHDJFTHDO-UHFFFAOYSA-N
XLogP1.01
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.34
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide?
The IUPAC name of N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide (CID 54972326) is N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide.
What is the SMILES notation for N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide?
The canonical SMILES for N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide is CC(NS(=O)(=O)C1CCCNC1)c1ccco1.
What is the InChIKey of N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide?
The InChIKey is BUZGUIHDJFTHDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S/c1-9(11-5-3-7-16-11)13-17(14,15)10-4-2-6-12-8-10/h3,5,7,9-10,12-13H,2,4,6,8H2,1H3.
What are the key properties of N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide?
N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide has a molecular weight of 258.34 g/mol, XLogP of 1.01, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)ethyl]piperidine-3-sulfonamide is sourced from PubChem (CID 54972326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).