5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide

C15H15BrN2O3S2 — CID 1305910

IUPAC5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide
SMILESO=C(c1ccccc1NS(=O)(=O)c1ccc(Br)s1)N1CCCC1
InChIInChI=1S/C15H15BrN2O3S2/c16-13-7-8-14(22-13)23(20,21)17-12-6-2-1-5-11(12)15(19)18-9-3-4-10-18/h1-2,5-8,17H,3-4,9-10H2
InChIKeyFHZFLXHJVJHPBR-UHFFFAOYSA-N
MW415.33 g/mol
LogP3.55
Rot. Bonds4

About 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide

5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide (PubChem CID 1305910) has the molecular formula C15H15BrN2O3S2 and a molecular weight of 415.33 g/mol. Its IUPAC name is 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide
PubChem CID1305910
Molecular FormulaC15H15BrN2O3S2
Molecular Weight415.33 g/mol
Exact Mass413.97
IUPAC Name5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide
SMILESO=C(c1ccccc1NS(=O)(=O)c1ccc(Br)s1)N1CCCC1
InChIInChI=1S/C15H15BrN2O3S2/c16-13-7-8-14(22-13)23(20,21)17-12-6-2-1-5-11(12)15(19)18-9-3-4-10-18/h1-2,5-8,17H,3-4,9-10H2
InChIKeyFHZFLXHJVJHPBR-UHFFFAOYSA-N
XLogP3.55
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.33
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide 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-bromo-N-[5-bromo-2-(piperidine-1-carbonyl)phenyl]-5-chlorothiophene-2-sulfonamide
CID 25033225
N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide
CID 650885
2-{[(5-bromo-2-thienyl)sulfonyl]amino}-N-(2-methoxyethyl)benzamide
CID 2210754
5-bromo-N-[2-(4-morpholinylcarbonyl)phenyl]-2-thiophenesulfonamide
CID 1284913
1-[4-[(5-Bromothiophen-2-yl)sulfonylamino]benzoyl]piperidine-4-carboxamide
CID 4855305
N,N-diethyl-2-[(thiophen-2-ylsulfonyl)amino]benzamide
CID 6461716
2-{[(5-bromo-2-thienyl)sulfonyl]amino}-N-isopropylbenzamide
CID 1210804
2-(5-Bromo-thiophene-2-sulfonylamino)-N-(tetrahydro-furan-2-ylmethyl)-benzamide
CID 6494047
N-[[5-[[5-bromo-2-(piperidine-1-carbonyl)phenyl]sulfamoyl]thiophen-2-yl]methyl]benzamide
CID 44445283
2-[(4-bromo-5-chlorothiophen-2-yl)sulfonylamino]-N,N-diethylbenzamide
CID 172435917
4-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]benzenesulfonamide
CID 1245474
2-[Methyl(thiophen-2-ylsulfonyl)amino]benzamide
CID 17432754

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide?
The IUPAC name of 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide (CID 1305910) is 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide is O=C(c1ccccc1NS(=O)(=O)c1ccc(Br)s1)N1CCCC1.
What is the InChIKey of 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide?
The InChIKey is FHZFLXHJVJHPBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O3S2/c16-13-7-8-14(22-13)23(20,21)17-12-6-2-1-5-11(12)15(19)18-9-3-4-10-18/h1-2,5-8,17H,3-4,9-10H2.
What are the key properties of 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide?
5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide has a molecular weight of 415.33 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[2-(pyrrolidine-1-carbonyl)phenyl]thiophene-2-sulfonamide is sourced from PubChem (CID 1305910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).