(4-methyl-1,3-thiazol-5-yl)methanesulfonamide

C5H8N2O2S2 — CID 112639898

IUPAC(4-methyl-1,3-thiazol-5-yl)methanesulfonamide
SMILESCc1ncsc1CS(N)(=O)=O
InChIInChI=1S/C5H8N2O2S2/c1-4-5(10-3-7-4)2-11(6,8)9/h3H,2H2,1H3,(H2,6,8,9)
InChIKeyLZYNMUGGIMCOJO-UHFFFAOYSA-N
MW192.26 g/mol
LogP0.24
Rot. Bonds2

About (4-methyl-1,3-thiazol-5-yl)methanesulfonamide

(4-methyl-1,3-thiazol-5-yl)methanesulfonamide (PubChem CID 112639898) has the molecular formula C5H8N2O2S2 and a molecular weight of 192.26 g/mol. Its IUPAC name is (4-methyl-1,3-thiazol-5-yl)methanesulfonamide.

Molecular Properties

Compound Name(4-methyl-1,3-thiazol-5-yl)methanesulfonamide
PubChem CID112639898
Molecular FormulaC5H8N2O2S2
Molecular Weight192.26 g/mol
Exact Mass192.00
IUPAC Name(4-methyl-1,3-thiazol-5-yl)methanesulfonamide
SMILESCc1ncsc1CS(N)(=O)=O
InChIInChI=1S/C5H8N2O2S2/c1-4-5(10-3-7-4)2-11(6,8)9/h3H,2H2,1H3,(H2,6,8,9)
InChIKeyLZYNMUGGIMCOJO-UHFFFAOYSA-N
XLogP0.24
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methyl-1,3-thiazol-5-yl)ethanamine;dihydrobromide
CID 53398787
N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide
CID 110718462
2-[(4-methyl-1,3-thiazol-5-yl)methylamino]benzenesulfonamide
CID 63280801
N-[(4-methyl-1,3-thiazol-5-yl)methyl]propane-2-sulfonamide
CID 63373679
4-amino-2,6-difluoro-N-[(4-methyl-1,3-thiazol-5-yl)methyl]benzenesulfonamide
CID 63280248
N-methyl-N-[(4-methyl-1,3-thiazol-5-yl)methyl]propane-2-sulfonamide
CID 63822516
5-bromo-2-[2-(4-methyl-1,3-thiazol-5-yl)ethoxy]benzenesulfonamide
CID 82915384
5-(2-iodoethyl)-4-methyl-1,3-thiazole
CID 3031968
2-(4-methyl-1,3-thiazol-5-yl)ethanethiol
CID 18690003
2-methyl-4-(4-methyl-1,3-thiazol-5-yl)butan-2-amine
CID 65015632
CID 66818170
CID 66818170
O-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]hydroxylamine
CID 11228942

Frequently Asked Questions

What is the IUPAC name of (4-methyl-1,3-thiazol-5-yl)methanesulfonamide?
The IUPAC name of (4-methyl-1,3-thiazol-5-yl)methanesulfonamide (CID 112639898) is (4-methyl-1,3-thiazol-5-yl)methanesulfonamide.
What is the SMILES notation for (4-methyl-1,3-thiazol-5-yl)methanesulfonamide?
The canonical SMILES for (4-methyl-1,3-thiazol-5-yl)methanesulfonamide is Cc1ncsc1CS(N)(=O)=O.
What is the InChIKey of (4-methyl-1,3-thiazol-5-yl)methanesulfonamide?
The InChIKey is LZYNMUGGIMCOJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N2O2S2/c1-4-5(10-3-7-4)2-11(6,8)9/h3H,2H2,1H3,(H2,6,8,9).
What are the key properties of (4-methyl-1,3-thiazol-5-yl)methanesulfonamide?
(4-methyl-1,3-thiazol-5-yl)methanesulfonamide has a molecular weight of 192.26 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-1,3-thiazol-5-yl)methanesulfonamide is sourced from PubChem (CID 112639898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).