N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide

C8H11F3N2O3S2 — CID 107483721

IUPACN-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)N(CCO)CC(F)(F)F)s1
InChIInChI=1S/C8H11F3N2O3S2/c1-6-12-4-7(17-6)18(15,16)13(2-3-14)5-8(9,10)11/h4,14H,2-3,5H2,1H3
InChIKeyMUFHZJRPCFZULI-UHFFFAOYSA-N
MW304.32 g/mol
LogP1.00
Rot. Bonds5

About N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide

N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide (PubChem CID 107483721) has the molecular formula C8H11F3N2O3S2 and a molecular weight of 304.32 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
PubChem CID107483721
Molecular FormulaC8H11F3N2O3S2
Molecular Weight304.32 g/mol
Exact Mass304.02
IUPAC NameN-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)N(CCO)CC(F)(F)F)s1
InChIInChI=1S/C8H11F3N2O3S2/c1-6-12-4-7(17-6)18(15,16)13(2-3-14)5-8(9,10)11/h4,14H,2-3,5H2,1H3
InChIKeyMUFHZJRPCFZULI-UHFFFAOYSA-N
XLogP1.00
TPSA70.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(Difluoromethyl)-1,3-thiazole-5-sulfonamide
CID 146571332
2-chloro-N-(2-hydroxyethyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 61046479
2-chloro-N-(3-ethoxypropyl)-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 61047432
2-methyl-N-(2,2,2-trifluoroethoxy)-1,3-thiazole-5-sulfonamide
CID 103414450
2-methyl-N-(3,3,3-trifluoro-2-hydroxypropyl)-1,3-thiazole-5-sulfonamide
CID 103847924
N-(3,3-difluoro-2-hydroxypropyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103847976
N-(2,2-difluoro-3-hydroxypropyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 104858755
2-[(2-Methyl-1,3-thiazol-5-yl)sulfonyl-(2,2,2-trifluoroethyl)amino]acetic acid
CID 104937138
2-chloro-N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-1,3-thiazole-5-sulfonamide
CID 107479246
N-(2-bromoethyl)-N-(2,2-difluoroethyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 107492795
N-(2,2-difluoroethyl)-N-(2-hydroxyethyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 113964806
N-(2-bromoethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide
CID 113966160

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide (CID 107483721) is N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide is Cc1ncc(S(=O)(=O)N(CCO)CC(F)(F)F)s1.
What is the InChIKey of N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide?
The InChIKey is MUFHZJRPCFZULI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11F3N2O3S2/c1-6-12-4-7(17-6)18(15,16)13(2-3-14)5-8(9,10)11/h4,14H,2-3,5H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide?
N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide has a molecular weight of 304.32 g/mol, XLogP of 1.00, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-methyl-N-(2,2,2-trifluoroethyl)-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 107483721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).