3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide

C10H14BrNO2S2 — CID 61073287

IUPAC3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide
SMILESCN(C1CCCC1)S(=O)(=O)c1sccc1Br
InChIInChI=1S/C10H14BrNO2S2/c1-12(8-4-2-3-5-8)16(13,14)10-9(11)6-7-15-10/h6-8H,2-5H2,1H3
InChIKeyWRSDEMGSTFUWDN-UHFFFAOYSA-N
MW324.27 g/mol
LogP3.07
Rot. Bonds3

About 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide

3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide (PubChem CID 61073287) has the molecular formula C10H14BrNO2S2 and a molecular weight of 324.27 g/mol. Its IUPAC name is 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide.

Molecular Properties

Compound Name3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide
PubChem CID61073287
Molecular FormulaC10H14BrNO2S2
Molecular Weight324.27 g/mol
Exact Mass322.96
IUPAC Name3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide
SMILESCN(C1CCCC1)S(=O)(=O)c1sccc1Br
InChIInChI=1S/C10H14BrNO2S2/c1-12(8-4-2-3-5-8)16(13,14)10-9(11)6-7-15-10/h6-8H,2-5H2,1H3
InChIKeyWRSDEMGSTFUWDN-UHFFFAOYSA-N
XLogP3.07
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.27
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-cyclopentyl-2-thiophenesulfonamide
CID 893383
3-bromo-N-cyclopropyl-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 54983854
3-bromo-N-methyl-N-(3,3,3-trifluoropropyl)thiophene-2-sulfonamide
CID 61384481
3-bromo-N-(1-cyclopropylethyl)-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 61456259
3-bromo-N-butyl-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 61456408
3-bromo-N-propyl-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 61456409
3-bromo-N-propan-2-yl-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 61456444
3-bromo-N-pentan-3-yl-N-(2,2,2-trifluoroethyl)thiophene-2-sulfonamide
CID 61456445
1-((5-Bromothiophen-2-yl)sulfonyl)-2-methylpiperidine
CID 6468880
5-bromo-N-(1,1-dioxothiolan-3-yl)-N-ethylthiophene-2-sulfonamide
CID 51169212
1-((5-Bromothiophen-2-yl)sulfonyl)-3-(methylsulfonyl)pyrrolidine
CID 71805556
5-bromo-N-methyl-N-propylthiophene-2-sulfonamide
CID 58169467

Frequently Asked Questions

What is the IUPAC name of 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide?
The IUPAC name of 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide (CID 61073287) is 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide.
What is the SMILES notation for 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide?
The canonical SMILES for 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide is CN(C1CCCC1)S(=O)(=O)c1sccc1Br.
What is the InChIKey of 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide?
The InChIKey is WRSDEMGSTFUWDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14BrNO2S2/c1-12(8-4-2-3-5-8)16(13,14)10-9(11)6-7-15-10/h6-8H,2-5H2,1H3.
What are the key properties of 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide?
3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide has a molecular weight of 324.27 g/mol, XLogP of 3.07, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-N-cyclopentyl-N-methylthiophene-2-sulfonamide is sourced from PubChem (CID 61073287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).