4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide

C14H15ClN2O2S2 — CID 99326118

IUPAC4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide
SMILESO=S(=O)(NC1(c2nccs2)CCCC1)c1ccc(Cl)cc1
InChIInChI=1S/C14H15ClN2O2S2/c15-11-3-5-12(6-4-11)21(18,19)17-14(7-1-2-8-14)13-16-9-10-20-13/h3-6,9-10,17H,1-2,7-8H2
InChIKeyFMZDVAJVESZNGL-UHFFFAOYSA-N
MW342.87 g/mol
LogP3.54
Rot. Bonds4

About 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide

4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide (PubChem CID 99326118) has the molecular formula C14H15ClN2O2S2 and a molecular weight of 342.87 g/mol. Its IUPAC name is 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide.

Molecular Properties

Compound Name4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide
PubChem CID99326118
Molecular FormulaC14H15ClN2O2S2
Molecular Weight342.87 g/mol
Exact Mass342.03
IUPAC Name4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide
SMILESO=S(=O)(NC1(c2nccs2)CCCC1)c1ccc(Cl)cc1
InChIInChI=1S/C14H15ClN2O2S2/c15-11-3-5-12(6-4-11)21(18,19)17-14(7-1-2-8-14)13-16-9-10-20-13/h3-6,9-10,17H,1-2,7-8H2
InChIKeyFMZDVAJVESZNGL-UHFFFAOYSA-N
XLogP3.54
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.87
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide?
The IUPAC name of 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide (CID 99326118) is 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide.
What is the SMILES notation for 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide?
The canonical SMILES for 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide is O=S(=O)(NC1(c2nccs2)CCCC1)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide?
The InChIKey is FMZDVAJVESZNGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O2S2/c15-11-3-5-12(6-4-11)21(18,19)17-14(7-1-2-8-14)13-16-9-10-20-13/h3-6,9-10,17H,1-2,7-8H2.
What are the key properties of 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide?
4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide has a molecular weight of 342.87 g/mol, XLogP of 3.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[1-(1,3-thiazol-2-yl)cyclopentyl]benzenesulfonamide is sourced from PubChem (CID 99326118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).