2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide

C11H17ClN2O2S2 — CID 55069221

IUPAC2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide
SMILESCC(NS(=O)(=O)c1cnc(Cl)s1)C1CCCCC1
InChIInChI=1S/C11H17ClN2O2S2/c1-8(9-5-3-2-4-6-9)14-18(15,16)10-7-13-11(12)17-10/h7-9,14H,2-6H2,1H3
InChIKeyFUUWPKFGFPBATA-UHFFFAOYSA-N
MW308.86 g/mol
LogP3.04
Rot. Bonds4

About 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide

2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide (PubChem CID 55069221) has the molecular formula C11H17ClN2O2S2 and a molecular weight of 308.86 g/mol. Its IUPAC name is 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide
PubChem CID55069221
Molecular FormulaC11H17ClN2O2S2
Molecular Weight308.86 g/mol
Exact Mass308.04
IUPAC Name2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide
SMILESCC(NS(=O)(=O)c1cnc(Cl)s1)C1CCCCC1
InChIInChI=1S/C11H17ClN2O2S2/c1-8(9-5-3-2-4-6-9)14-18(15,16)10-7-13-11(12)17-10/h7-9,14H,2-6H2,1H3
InChIKeyFUUWPKFGFPBATA-UHFFFAOYSA-N
XLogP3.04
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.86
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[1-(oxolan-2-yl)ethyl]-1,3-thiazole-5-sulfonamide
CID 43533896
5,6-dichloro-N-(1-cyclohexylethyl)pyridine-3-sulfonamide
CID 64608609
2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-propan-2-ylpropanamide
CID 113406898
2-chloro-N-(2-methylpentan-3-yl)-1,3-thiazole-5-sulfonamide
CID 61472310
N-(1-cyclohexylethyl)-2-hydrazinylpyrimidine-5-sulfonamide
CID 62405635
methyl 2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-3-methylbutanoate
CID 43455982
2-chloro-N-(4-methoxybutan-2-yl)-1,3-thiazole-5-sulfonamide
CID 64603615
N-[1-(4-bromophenyl)ethyl]-2-chloro-1,3-thiazole-5-sulfonamide
CID 61053705
2-chloro-N-(3-hydroxycyclohexyl)-1,3-thiazole-5-sulfonamide
CID 61051756
2-chloro-N-(2-propan-2-yloxyethyl)-1,3-thiazole-5-sulfonamide
CID 104760009
N-[1-[(2-chloro-1,3-thiazol-5-yl)sulfonyl]piperidin-3-yl]methanesulfonamide
CID 61047427
2-[(2-chloro-1,3-thiazol-5-yl)sulfonylamino]-N-cyclopropylacetamide
CID 43568485

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide (CID 55069221) is 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide is CC(NS(=O)(=O)c1cnc(Cl)s1)C1CCCCC1.
What is the InChIKey of 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide?
The InChIKey is FUUWPKFGFPBATA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17ClN2O2S2/c1-8(9-5-3-2-4-6-9)14-18(15,16)10-7-13-11(12)17-10/h7-9,14H,2-6H2,1H3.
What are the key properties of 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide?
2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide has a molecular weight of 308.86 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-(1-cyclohexylethyl)-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 55069221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).