N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide

C14H19NO4S — CID 131702580

IUPACN-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NCC(c1ccco1)c1ccco1
InChIInChI=1S/C14H19NO4S/c1-2-3-10-20(16,17)15-11-12(13-6-4-8-18-13)14-7-5-9-19-14/h4-9,12,15H,2-3,10-11H2,1H3
InChIKeyUIMNXIRJNXFSMG-UHFFFAOYSA-N
MW297.38 g/mol
LogP2.72
Rot. Bonds8

About N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide

N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide (PubChem CID 131702580) has the molecular formula C14H19NO4S and a molecular weight of 297.38 g/mol. Its IUPAC name is N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide.

Molecular Properties

Compound NameN-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide
PubChem CID131702580
Molecular FormulaC14H19NO4S
Molecular Weight297.38 g/mol
Exact Mass297.10
IUPAC NameN-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide
SMILESCCCCS(=O)(=O)NCC(c1ccco1)c1ccco1
InChIInChI=1S/C14H19NO4S/c1-2-3-10-20(16,17)15-11-12(13-6-4-8-18-13)14-7-5-9-19-14/h4-9,12,15H,2-3,10-11H2,1H3
InChIKeyUIMNXIRJNXFSMG-UHFFFAOYSA-N
XLogP2.72
TPSA72.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2,2-bis(furan-2-yl)ethyl]cyclopropanesulfonamide
CID 131701798
N-[3-(furan-2-yl)-3-hydroxypropyl]propane-1-sulfonamide
CID 90523800
N-[(2R)-2-(furan-2-yl)-2-(4-propan-2-ylphenyl)sulfonylethyl]propane-1-sulfonamide
CID 9161431
N-(2-phenyl-2-pyridin-2-ylethyl)butane-1-sulfonamide
CID 110362891
N-[2,2-bis(furan-2-yl)ethyl]-2-methoxybenzenesulfonamide
CID 131702585
N-[2,2-bis(furan-2-yl)ethyl]-3-chloro-2-methylbenzenesulfonamide
CID 131702588
N-[2-(furan-2-yl)-2-thiophen-3-ylethyl]-1-phenylmethanesulfonamide
CID 126852124
4-chloro-N-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]butane-1-sulfonamide
CID 116815945
N-[(1R)-1-(furan-2-yl)ethyl]ethanesulfonamide
CID 81400303
N-[2-(4-fluorophenyl)-2-pyridin-2-ylethyl]butane-1-sulfonamide
CID 110362944
N-(3-hydroxy-3-phenylpropyl)butane-1-sulfonamide
CID 111466269
N-[2,2-bis(furan-2-yl)ethyl]-4-methoxy-2-methylbenzenesulfonamide
CID 131702587

Frequently Asked Questions

What is the IUPAC name of N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide?
The IUPAC name of N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide (CID 131702580) is N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide.
What is the SMILES notation for N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide?
The canonical SMILES for N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide is CCCCS(=O)(=O)NCC(c1ccco1)c1ccco1.
What is the InChIKey of N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide?
The InChIKey is UIMNXIRJNXFSMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO4S/c1-2-3-10-20(16,17)15-11-12(13-6-4-8-18-13)14-7-5-9-19-14/h4-9,12,15H,2-3,10-11H2,1H3.
What are the key properties of N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide?
N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide has a molecular weight of 297.38 g/mol, XLogP of 2.72, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,2-bis(furan-2-yl)ethyl]butane-1-sulfonamide is sourced from PubChem (CID 131702580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).