2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide

C15H19BrFNO2S — CID 55906746

IUPAC2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide
SMILESO=S(=O)(c1ccc(F)cc1Br)N(C1CCCCC1)C1CC1
InChIInChI=1S/C15H19BrFNO2S/c16-14-10-11(17)6-9-15(14)21(19,20)18(13-7-8-13)12-4-2-1-3-5-12/h6,9-10,12-13H,1-5,7-8H2
InChIKeyGKZYECYBOAWABO-UHFFFAOYSA-N
MW376.29 g/mol
LogP4.07
Rot. Bonds4

About 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide

2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide (PubChem CID 55906746) has the molecular formula C15H19BrFNO2S and a molecular weight of 376.29 g/mol. Its IUPAC name is 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide.

Molecular Properties

Compound Name2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide
PubChem CID55906746
Molecular FormulaC15H19BrFNO2S
Molecular Weight376.29 g/mol
Exact Mass375.03
IUPAC Name2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide
SMILESO=S(=O)(c1ccc(F)cc1Br)N(C1CCCCC1)C1CC1
InChIInChI=1S/C15H19BrFNO2S/c16-14-10-11(17)6-9-15(14)21(19,20)18(13-7-8-13)12-4-2-1-3-5-12/h6,9-10,12-13H,1-5,7-8H2
InChIKeyGKZYECYBOAWABO-UHFFFAOYSA-N
XLogP4.07
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.29
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide 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

2-bromo-N-(cyclobutylmethyl)-4-fluoro-N-methylbenzenesulfonamide
CID 62854427
N-(azetidin-3-yl)-2-bromo-4-fluoro-N-methylbenzenesulfonamide
CID 66186864
2-bromo-4-fluoro-N-methyl-N-pyrrolidin-3-ylbenzenesulfonamide
CID 63297707
2-[(2-bromo-4-fluorophenyl)sulfonyl-(2-cyclohexylethyl)amino]acetamide
CID 86879612
4-amino-2-bromo-N-cyclohexyl-N-methylbenzenesulfonamide
CID 43255875
2,4-dibromo-N-cyclopropyl-N-(1,1-dioxothiolan-3-yl)benzenesulfonamide
CID 55873872
N-[(1R,2S)-2-(aminomethyl)cyclopentyl]-2-bromo-4-fluorobenzenesulfonamide
CID 124513957
2-bromo-4-fluoro-N-[(1S,2S)-2-hydroxycyclohexyl]benzenesulfonamide
CID 104953223
N-[2-(aminomethyl)cyclopentyl]-2-bromo-4-fluorobenzenesulfonamide;hydrochloride
CID 119985739
2-bromo-4-fluoro-N-piperidin-4-yl-N-propylbenzenesulfonamide;hydrochloride
CID 119993945
2-bromo-4-fluoro-N-[(2-methylcyclohexyl)methyl]benzenesulfonamide
CID 63420657
2-bromo-4-fluoro-N-methyl-N-(oxan-4-ylmethyl)benzenesulfonamide
CID 63707428

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide?
The IUPAC name of 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide (CID 55906746) is 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide.
What is the SMILES notation for 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide?
The canonical SMILES for 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide is O=S(=O)(c1ccc(F)cc1Br)N(C1CCCCC1)C1CC1.
What is the InChIKey of 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide?
The InChIKey is GKZYECYBOAWABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19BrFNO2S/c16-14-10-11(17)6-9-15(14)21(19,20)18(13-7-8-13)12-4-2-1-3-5-12/h6,9-10,12-13H,1-5,7-8H2.
What are the key properties of 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide?
2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide has a molecular weight of 376.29 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-cyclohexyl-N-cyclopropyl-4-fluorobenzenesulfonamide is sourced from PubChem (CID 55906746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).