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

C10H16N2O3S2 — CID 54884468

IUPACN-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)NCC1CCCC1
InChIInChI=1S/C10H16N2O3S2/c1-7-9(16-10(13)12-7)17(14,15)11-6-8-4-2-3-5-8/h8,11H,2-6H2,1H3,(H,12,13)
InChIKeyWMDSYWRSQIVANW-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.21
Rot. Bonds4

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

N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (PubChem CID 54884468) has the molecular formula C10H16N2O3S2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
PubChem CID54884468
Molecular FormulaC10H16N2O3S2
Molecular Weight276.38 g/mol
Exact Mass276.06
IUPAC NameN-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide
SMILESCc1[nH]c(=O)sc1S(=O)(=O)NCC1CCCC1
InChIInChI=1S/C10H16N2O3S2/c1-7-9(16-10(13)12-7)17(14,15)11-6-8-4-2-3-5-8/h8,11H,2-6H2,1H3,(H,12,13)
InChIKeyWMDSYWRSQIVANW-UHFFFAOYSA-N
XLogP1.21
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide (CID 54884468) is N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is Cc1[nH]c(=O)sc1S(=O)(=O)NCC1CCCC1.
What is the InChIKey of N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
The InChIKey is WMDSYWRSQIVANW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S2/c1-7-9(16-10(13)12-7)17(14,15)11-6-8-4-2-3-5-8/h8,11H,2-6H2,1H3,(H,12,13).
What are the key properties of N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide?
N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide has a molecular weight of 276.38 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopentylmethyl)-4-methyl-2-oxo-3H-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 54884468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).