N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide

C12H16FNO3S — CID 61045049

IUPACN-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide
SMILESCOCCN(C1CC1)S(=O)(=O)c1ccccc1F
InChIInChI=1S/C12H16FNO3S/c1-17-9-8-14(10-6-7-10)18(15,16)12-5-3-2-4-11(12)13/h2-5,10H,6-9H2,1H3
InChIKeyYQSVRRHPHXHJGY-UHFFFAOYSA-N
MW273.33 g/mol
LogP1.63
Rot. Bonds6

About N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide

N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide (PubChem CID 61045049) has the molecular formula C12H16FNO3S and a molecular weight of 273.33 g/mol. Its IUPAC name is N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide
PubChem CID61045049
Molecular FormulaC12H16FNO3S
Molecular Weight273.33 g/mol
Exact Mass273.08
IUPAC NameN-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide
SMILESCOCCN(C1CC1)S(=O)(=O)c1ccccc1F
InChIInChI=1S/C12H16FNO3S/c1-17-9-8-14(10-6-7-10)18(15,16)12-5-3-2-4-11(12)13/h2-5,10H,6-9H2,1H3
InChIKeyYQSVRRHPHXHJGY-UHFFFAOYSA-N
XLogP1.63
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.33
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)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

N-cyclopropyl-2-fluoro-N-(2-hydroxyethyl)benzenesulfonamide
CID 43577535
3-[cyclopropyl(2-methoxyethyl)sulfamoyl]-4-fluorobenzoic acid
CID 60951447
2-(chloromethyl)-N-cyclopropyl-5-fluoro-N-(2-methoxyethyl)benzenesulfonamide
CID 102920088
3-[cyclopropyl-(2-fluorophenyl)sulfonylamino]-N'-hydroxypropanimidamide
CID 76911739
5-(aminomethyl)-N-cyclopropyl-2,3-difluoro-N-(2-methoxyethyl)benzenesulfonamide
CID 105120761
2-[cyclopropyl-(2-fluorophenyl)sulfonylamino]acetic acid
CID 54945752
3-amino-N-cyclopropyl-4-fluoro-N-(2-methoxyethyl)benzenesulfonamide
CID 61109405
N-cyclopropyl-2-fluoro-N-(thiophen-2-ylmethyl)benzenesulfonamide
CID 35389306
2,5-dibromo-N-cyclopropyl-N-(2-methoxyethyl)-4-methylbenzenesulfonamide
CID 80708665
5-amino-N-cyclopropyl-N-(2-methoxyethyl)-2-nitrobenzenesulfonamide
CID 62156814
2-fluoro-N-propyl-N-pyrrolidin-3-ylbenzenesulfonamide;hydrochloride
CID 119976534
5-[cyclopropyl(2-methoxyethyl)sulfamoyl]-2-fluorobenzenecarbothioamide
CID 63288473

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide?
The IUPAC name of N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide (CID 61045049) is N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide.
What is the SMILES notation for N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide?
The canonical SMILES for N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide is COCCN(C1CC1)S(=O)(=O)c1ccccc1F.
What is the InChIKey of N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide?
The InChIKey is YQSVRRHPHXHJGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO3S/c1-17-9-8-14(10-6-7-10)18(15,16)12-5-3-2-4-11(12)13/h2-5,10H,6-9H2,1H3.
What are the key properties of N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide?
N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide has a molecular weight of 273.33 g/mol, XLogP of 1.63, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-fluoro-N-(2-methoxyethyl)benzenesulfonamide is sourced from PubChem (CID 61045049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).