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

C12H20N2O3S — CID 42958060

IUPACN-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide
SMILESCC(Cc1ccco1)NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C12H20N2O3S/c1-11(10-12-6-5-9-17-12)13-18(15,16)14-7-3-2-4-8-14/h5-6,9,11,13H,2-4,7-8,10H2,1H3
InChIKeyUTOSOVZVKZOMHX-UHFFFAOYSA-N
MW272.37 g/mol
LogP1.53
Rot. Bonds5

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

N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide (PubChem CID 42958060) has the molecular formula C12H20N2O3S and a molecular weight of 272.37 g/mol. Its IUPAC name is N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide.

Molecular Properties

Compound NameN-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide
PubChem CID42958060
Molecular FormulaC12H20N2O3S
Molecular Weight272.37 g/mol
Exact Mass272.12
IUPAC NameN-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide
SMILESCC(Cc1ccco1)NS(=O)(=O)N1CCCCC1
InChIInChI=1S/C12H20N2O3S/c1-11(10-12-6-5-9-17-12)13-18(15,16)14-7-3-2-4-8-14/h5-6,9,11,13H,2-4,7-8,10H2,1H3
InChIKeyUTOSOVZVKZOMHX-UHFFFAOYSA-N
XLogP1.53
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide?
The IUPAC name of N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide (CID 42958060) is N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide.
What is the SMILES notation for N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide?
The canonical SMILES for N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide is CC(Cc1ccco1)NS(=O)(=O)N1CCCCC1.
What is the InChIKey of N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide?
The InChIKey is UTOSOVZVKZOMHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3S/c1-11(10-12-6-5-9-17-12)13-18(15,16)14-7-3-2-4-8-14/h5-6,9,11,13H,2-4,7-8,10H2,1H3.
What are the key properties of N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide?
N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide has a molecular weight of 272.37 g/mol, XLogP of 1.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)propan-2-yl]piperidine-1-sulfonamide is sourced from PubChem (CID 42958060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).