3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide

C14H18N2O3S — CID 60873785

IUPAC3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide
SMILESCCC(N)c1cccc(S(=O)(=O)NCc2ccco2)c1
InChIInChI=1S/C14H18N2O3S/c1-2-14(15)11-5-3-7-13(9-11)20(17,18)16-10-12-6-4-8-19-12/h3-9,14,16H,2,10,15H2,1H3
InChIKeyIXHAEOJQMTZLSR-UHFFFAOYSA-N
MW294.38 g/mol
LogP2.17
Rot. Bonds6

About 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide

3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide (PubChem CID 60873785) has the molecular formula C14H18N2O3S and a molecular weight of 294.38 g/mol. Its IUPAC name is 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide.

Molecular Properties

Compound Name3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide
PubChem CID60873785
Molecular FormulaC14H18N2O3S
Molecular Weight294.38 g/mol
Exact Mass294.10
IUPAC Name3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide
SMILESCCC(N)c1cccc(S(=O)(=O)NCc2ccco2)c1
InChIInChI=1S/C14H18N2O3S/c1-2-14(15)11-5-3-7-13(9-11)20(17,18)16-10-12-6-4-8-19-12/h3-9,14,16H,2,10,15H2,1H3
InChIKeyIXHAEOJQMTZLSR-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 3-(1-aminopropyl)-N-(furan-2-ylmethyl)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-(1-aminopropyl)-N-(pyridin-4-ylmethyl)benzenesulfonamide
CID 60872660
2-[[3-(1-aminopropyl)phenyl]sulfonylamino]-N-propan-2-ylacetamide
CID 60872861
3-(1-aminopropyl)-N-(cyclopropylmethyl)benzenesulfonamide
CID 60874157
3-(furan-2-ylmethylsulfamoyl)-N-(1-phenylethyl)benzamide
CID 43006795
3-(furan-2-ylmethylsulfamoyl)benzoic acid
CID 972732
1-(3-methylsulfonylphenyl)propan-1-amine
CID 66935160
N-(furan-2-ylmethyl)-4-(1-hydroxyethyl)benzenesulfonamide
CID 17490399
3-(furan-2-ylmethylsulfamoyl)-N,N-dipropylbenzamide
CID 109064446
3,4-dichloro-N-(furan-2-ylmethyl)benzenesulfonamide
CID 738690
3-chloro-N-[3-(furan-2-ylmethylsulfamoyl)phenyl]-4-methylbenzenesulfonamide
CID 55880160
N-[3-(furan-2-ylmethylsulfamoyl)phenyl]pentanamide
CID 51154986
3-(1-aminopropyl)-N-pyrimidin-5-ylbenzenesulfonamide
CID 107588975

Frequently Asked Questions

What is the IUPAC name of 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide?
The IUPAC name of 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide (CID 60873785) is 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide.
What is the SMILES notation for 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide?
The canonical SMILES for 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide is CCC(N)c1cccc(S(=O)(=O)NCc2ccco2)c1.
What is the InChIKey of 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide?
The InChIKey is IXHAEOJQMTZLSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3S/c1-2-14(15)11-5-3-7-13(9-11)20(17,18)16-10-12-6-4-8-19-12/h3-9,14,16H,2,10,15H2,1H3.
What are the key properties of 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide?
3-(1-aminopropyl)-N-(furan-2-ylmethyl)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 3-(1-aminopropyl)-N-(furan-2-ylmethyl)benzenesulfonamide is sourced from PubChem (CID 60873785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).