N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide

C10H16N2O3S2 — CID 103270180

IUPACN-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)NCC2CCC(O)C2)s1
InChIInChI=1S/C10H16N2O3S2/c1-7-11-6-10(16-7)17(14,15)12-5-8-2-3-9(13)4-8/h6,8-9,12-13H,2-5H2,1H3
InChIKeyKTBPBULDMJKYAG-UHFFFAOYSA-N
MW276.38 g/mol
LogP0.89
Rot. Bonds4

About N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide

N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide (PubChem CID 103270180) has the molecular formula C10H16N2O3S2 and a molecular weight of 276.38 g/mol. Its IUPAC name is N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide
PubChem CID103270180
Molecular FormulaC10H16N2O3S2
Molecular Weight276.38 g/mol
Exact Mass276.06
IUPAC NameN-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)NCC2CCC(O)C2)s1
InChIInChI=1S/C10H16N2O3S2/c1-7-11-6-10(16-7)17(14,15)12-5-8-2-3-9(13)4-8/h6,8-9,12-13H,2-5H2,1H3
InChIKeyKTBPBULDMJKYAG-UHFFFAOYSA-N
XLogP0.89
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-chloro-N-[(2-hydroxycyclopentyl)methyl]-1,3-thiazole-5-sulfonamide
CID 65838865
2-chloro-N-[[2-(hydroxymethyl)cyclopentyl]methyl]-1,3-thiazole-5-sulfonamide
CID 65927107
2-chloro-N-(2-ethyl-4-hydroxybutyl)-1,3-thiazole-5-sulfonamide
CID 80290206
N-[(3-hydroxycyclobutyl)methyl]-N,2-dimethyl-1,3-thiazole-5-sulfonamide
CID 102794960
N-[1-(hydroxymethyl)cyclopentyl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414840
N-[1-(hydroxymethyl)cyclohexyl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414842
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414856
N-[[2-(hydroxymethyl)cyclohexyl]methyl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414857
N-[(3-hydroxycyclobutyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414866
N-(2-hydroxy-2,4-dimethylpentyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414870
N-(4-hydroxycyclohexyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103847841
N-[(1-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide
CID 103847915

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide (CID 103270180) is N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide is Cc1ncc(S(=O)(=O)NCC2CCC(O)C2)s1.
What is the InChIKey of N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide?
The InChIKey is KTBPBULDMJKYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3S2/c1-7-11-6-10(16-7)17(14,15)12-5-8-2-3-9(13)4-8/h6,8-9,12-13H,2-5H2,1H3.
What are the key properties of N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide?
N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide has a molecular weight of 276.38 g/mol, XLogP of 0.89, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxycyclopentyl)methyl]-2-methyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 103270180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).