5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide

C11H11FN2O3S — CID 106060640

IUPAC5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide
SMILESNCc1ccc(S(=O)(=O)Nc2cccc(F)c2)o1
InChIInChI=1S/C11H11FN2O3S/c12-8-2-1-3-9(6-8)14-18(15,16)11-5-4-10(7-13)17-11/h1-6,14H,7,13H2
InChIKeyBMOLLMMCMWTOIY-UHFFFAOYSA-N
MW270.28 g/mol
LogP1.68
Rot. Bonds4

About 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide

5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide (PubChem CID 106060640) has the molecular formula C11H11FN2O3S and a molecular weight of 270.28 g/mol. Its IUPAC name is 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide.

Molecular Properties

Compound Name5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide
PubChem CID106060640
Molecular FormulaC11H11FN2O3S
Molecular Weight270.28 g/mol
Exact Mass270.05
IUPAC Name5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide
SMILESNCc1ccc(S(=O)(=O)Nc2cccc(F)c2)o1
InChIInChI=1S/C11H11FN2O3S/c12-8-2-1-3-9(6-8)14-18(15,16)11-5-4-10(7-13)17-11/h1-6,14H,7,13H2
InChIKeyBMOLLMMCMWTOIY-UHFFFAOYSA-N
XLogP1.68
TPSA85.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(aminomethyl)-N-(2,3-dihydro-1H-inden-5-yl)furan-2-sulfonamide
CID 106059570
2-(aminomethyl)-5-fluoro-N-(3-fluorophenyl)benzenesulfonamide
CID 106060604
N-[3-(aminomethyl)phenyl]-3-fluorobenzenesulfonamide
CID 16778006
5-(aminomethyl)-N-(3-chloro-4-methoxyphenyl)furan-2-sulfonamide
CID 106048091
5-(aminomethyl)-N-naphthalen-1-ylfuran-2-sulfonamide
CID 106040339
5-(aminomethyl)-2,4-dichloro-N-(3-fluorophenyl)benzenesulfonamide
CID 106060630
5-(aminomethyl)-N-[4-(difluoromethoxy)phenyl]furan-2-sulfonamide
CID 106030486
N-(3-fluorophenyl)-5-(3-methyl-1,2-oxazol-5-yl)furan-2-sulfonamide
CID 53085812
2-amino-4-fluoro-N-(3-fluorophenyl)benzenesulfonamide
CID 29053554
1-fluoro-3-(sulfamoylamino)benzene
CID 112573204
5-(aminomethyl)-N-[2-(difluoromethoxy)phenyl]furan-2-sulfonamide
CID 106030466
N-(3-chloro-5-fluorophenyl)-5-(methylaminomethyl)furan-2-sulfonamide
CID 106087933

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide?
The IUPAC name of 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide (CID 106060640) is 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide.
What is the SMILES notation for 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide?
The canonical SMILES for 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide is NCc1ccc(S(=O)(=O)Nc2cccc(F)c2)o1.
What is the InChIKey of 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide?
The InChIKey is BMOLLMMCMWTOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11FN2O3S/c12-8-2-1-3-9(6-8)14-18(15,16)11-5-4-10(7-13)17-11/h1-6,14H,7,13H2.
What are the key properties of 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide?
5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide has a molecular weight of 270.28 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N-(3-fluorophenyl)furan-2-sulfonamide is sourced from PubChem (CID 106060640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).