4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide

C14H18N2O3S — CID 62632675

IUPAC4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide
SMILESCCC(NCc1ccc(S(N)(=O)=O)cc1)c1ccco1
InChIInChI=1S/C14H18N2O3S/c1-2-13(14-4-3-9-19-14)16-10-11-5-7-12(8-6-11)20(15,17)18/h3-9,13,16H,2,10H2,1H3,(H2,15,17,18)
InChIKeyCUZHJEPNGPSMFM-UHFFFAOYSA-N
MW294.38 g/mol
LogP2.17
Rot. Bonds6

About 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide

4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide (PubChem CID 62632675) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide.

Molecular Properties

Compound Name4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide
PubChem CID62632675
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC Name4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide
SMILESCCC(NCc1ccc(S(N)(=O)=O)cc1)c1ccco1
InChIInChI=1S/C14H18N2O3S/c1-2-13(14-4-3-9-19-14)16-10-11-5-7-12(8-6-11)20(15,17)18/h3-9,13,16H,2,10H2,1H3,(H2,15,17,18)
InChIKeyCUZHJEPNGPSMFM-UHFFFAOYSA-N
XLogP2.17
TPSA85.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide 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

3-bromo-4-[1-(furan-2-yl)propylamino]benzenesulfonamide
CID 62632723
3-[1-(furan-2-yl)propylamino]benzenesulfonamide
CID 62634130
1-(furan-2-yl)-N-(pyridin-3-ylmethyl)propan-1-amine
CID 62633957
1-(furan-2-yl)-N-(1H-pyrazol-4-ylmethyl)propan-1-amine
CID 62633449
N'-[1-(furan-2-yl)propyl]ethane-1,2-diamine
CID 62633441
4-[(1,1-difluoropropan-2-ylamino)methyl]benzenesulfonamide
CID 102867736
2-[1-(furan-2-yl)propylamino]-N-propan-2-ylacetamide
CID 62633589
1-(furan-2-yl)-N-[(2-methoxy-4-pyridinyl)methyl]propan-1-amine
CID 62990396
4-[[(2-methyl-1-thiophen-2-ylpropyl)amino]methyl]benzenesulfonamide
CID 43760203
4-[1-(furan-2-yl)propylamino]-N-methylbenzenesulfonamide
CID 62631473
N'-[1-(furan-2-yl)propyl]butane-1,4-diamine
CID 62633443
N-[2-(4-chlorophenyl)ethyl]-1-(furan-2-yl)propan-1-amine
CID 55097343

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide?
The IUPAC name of 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide (CID 62632675) is 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide.
What is the SMILES notation for 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide?
The canonical SMILES for 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide is CCC(NCc1ccc(S(N)(=O)=O)cc1)c1ccco1.
What is the InChIKey of 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide?
The InChIKey is CUZHJEPNGPSMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-2-13(14-4-3-9-19-14)16-10-11-5-7-12(8-6-11)20(15,17)18/h3-9,13,16H,2,10H2,1H3,(H2,15,17,18).
What are the key properties of 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide?
4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide has a molecular weight of 294.38 g/mol, XLogP of 2.17, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(furan-2-yl)propylamino]methyl]benzenesulfonamide is sourced from PubChem (CID 62632675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).