N-ethyl-4-fluoro-N-propylbenzenesulfonamide

C11H16FNO2S — CID 43414951

IUPACN-ethyl-4-fluoro-N-propylbenzenesulfonamide
SMILESCCCN(CC)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C11H16FNO2S/c1-3-9-13(4-2)16(14,15)11-7-5-10(12)6-8-11/h5-8H,3-4,9H2,1-2H3
InChIKeyPORBYLGUYYQYIS-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.25
Rot. Bonds5

About N-ethyl-4-fluoro-N-propylbenzenesulfonamide

N-ethyl-4-fluoro-N-propylbenzenesulfonamide (PubChem CID 43414951) has the molecular formula C11H16FNO2S and a molecular weight of 245.32 g/mol. Its IUPAC name is N-ethyl-4-fluoro-N-propylbenzenesulfonamide.

Molecular Properties

Compound NameN-ethyl-4-fluoro-N-propylbenzenesulfonamide
PubChem CID43414951
Molecular FormulaC11H16FNO2S
Molecular Weight245.32 g/mol
Exact Mass245.09
IUPAC NameN-ethyl-4-fluoro-N-propylbenzenesulfonamide
SMILESCCCN(CC)S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C11H16FNO2S/c1-3-9-13(4-2)16(14,15)11-7-5-10(12)6-8-11/h5-8H,3-4,9H2,1-2H3
InChIKeyPORBYLGUYYQYIS-UHFFFAOYSA-N
XLogP2.25
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N-ethyl-4-fluoro-N-propylbenzenesulfonamide 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-ethyl-4-methyl-N-propylbenzenesulfonamide
CID 91734520
N-[3-(diethylamino)propyl]-N-ethyl-4-fluorobenzenesulfonamide
CID 102992728
N-ethyl-4-hydroxy-N-propylbenzenesulfonamide
CID 43269048
4-fluoro-N,N-dihexylbenzenesulfonamide
CID 3650162
2-[(4-fluorophenyl)sulfonyl-propylamino]-N'-hydroxyethanimidamide
CID 76927441
N-ethyl-4-(methylaminomethyl)-N-propylbenzenesulfonamide
CID 60823564
2-[(4-fluorophenyl)sulfonyl-propylamino]-N-propylacetamide
CID 60627428
4-[butyl(ethyl)sulfamoyl]benzenesulfonyl fluoride
CID 114791222
3-amino-N-ethyl-5-fluoro-N-propylbenzenesulfonamide
CID 63322173
4-formyl-N,N-dipropylbenzenesulfonamide
CID 138962999
N-(3-amino-2,2-dimethylpropyl)-N-ethyl-4-fluorobenzenesulfonamide
CID 79667940
4-(dipropylsulfamoyl)benzenesulfonyl chloride
CID 154093021

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-fluoro-N-propylbenzenesulfonamide?
The IUPAC name of N-ethyl-4-fluoro-N-propylbenzenesulfonamide (CID 43414951) is N-ethyl-4-fluoro-N-propylbenzenesulfonamide.
What is the SMILES notation for N-ethyl-4-fluoro-N-propylbenzenesulfonamide?
The canonical SMILES for N-ethyl-4-fluoro-N-propylbenzenesulfonamide is CCCN(CC)S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-4-fluoro-N-propylbenzenesulfonamide?
The InChIKey is PORBYLGUYYQYIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FNO2S/c1-3-9-13(4-2)16(14,15)11-7-5-10(12)6-8-11/h5-8H,3-4,9H2,1-2H3.
What are the key properties of N-ethyl-4-fluoro-N-propylbenzenesulfonamide?
N-ethyl-4-fluoro-N-propylbenzenesulfonamide has a molecular weight of 245.32 g/mol, XLogP of 2.25, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-fluoro-N-propylbenzenesulfonamide is sourced from PubChem (CID 43414951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).