N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide

C11H18N2O3S2 — CID 54884327

IUPACN-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)NCCC1CCCC1
InChIInChI=1S/C11H18N2O3S2/c1-8-10(17-11(14)13-8)18(15,16)12-7-6-9-4-2-3-5-9/h9,12H,2-7H2,1H3,(H,13,14)
InChIKeyLFVSTSNWKUHVAD-UHFFFAOYSA-N
MW290.41 g/mol
LogP1.60
Rot. Bonds5

About N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide

N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (PubChem CID 54884327) has the molecular formula C11H18N2O3S2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
PubChem CID54884327
Molecular FormulaC11H18N2O3S2
Molecular Weight290.41 g/mol
Exact Mass290.08
IUPAC NameN-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)NCCC1CCCC1
InChIInChI=1S/C11H18N2O3S2/c1-8-10(17-11(14)13-8)18(15,16)12-7-6-9-4-2-3-5-9/h9,12H,2-7H2,1H3,(H,13,14)
InChIKeyLFVSTSNWKUHVAD-UHFFFAOYSA-N
XLogP1.60
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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CID 54883894
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CID 54884374
CID 54884374
CID 54884468
CID 54884468
CID 54884469
CID 54884469
CID 54913972
CID 54913972
CID 54952907
CID 54952907
CID 54955518
CID 54955518
CID 55012231
CID 55012231
CID 55261932
CID 55261932

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (CID 54884327) is N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is Cc1[nH]c(=O)sc1S(=O)(=O)NCCC1CCCC1.
What is the InChIKey of N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is LFVSTSNWKUHVAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S2/c1-8-10(17-11(14)13-8)18(15,16)12-7-6-9-4-2-3-5-9/h9,12H,2-7H2,1H3,(H,13,14).
What are the key properties of N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 290.41 g/mol, XLogP of 1.60, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 54884327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).