N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide

C7H12N2O2S2 — CID 110718462

IUPACN-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide
SMILESCc1ncsc1CCNS(C)(=O)=O
InChIInChI=1S/C7H12N2O2S2/c1-6-7(12-5-8-6)3-4-9-13(2,10)11/h5,9H,3-4H2,1-2H3
InChIKeyWIMJFQXINZFDAL-UHFFFAOYSA-N
MW220.32 g/mol
LogP0.54
Rot. Bonds4

About N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide

N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide (PubChem CID 110718462) has the molecular formula C7H12N2O2S2 and a molecular weight of 220.32 g/mol. Its IUPAC name is N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide
PubChem CID110718462
Molecular FormulaC7H12N2O2S2
Molecular Weight220.32 g/mol
Exact Mass220.03
IUPAC NameN-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide
SMILESCc1ncsc1CCNS(C)(=O)=O
InChIInChI=1S/C7H12N2O2S2/c1-6-7(12-5-8-6)3-4-9-13(2,10)11/h5,9H,3-4H2,1-2H3
InChIKeyWIMJFQXINZFDAL-UHFFFAOYSA-N
XLogP0.54
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-chlorophenyl)-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide
CID 110718503
1-(4-fluorophenyl)-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide
CID 110718501
4-tert-butyl-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]benzenesulfonamide
CID 110718513
1-(2-chlorophenyl)-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide
CID 110718502
N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-3-phenylpropane-1-sulfonamide
CID 110718507
N-ethoxy-2-(4-methyl-1,3-thiazol-5-yl)ethanamine
CID 64687165
4-fluoro-2-methyl-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]benzenesulfonamide
CID 110718479
4-methoxy-2,5-dimethyl-N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]benzenesulfonamide
CID 110718489
2-(4-methyl-1,3-thiazol-5-yl)ethanethiol
CID 18690003
N-[2-(1,3-benzothiazol-6-yl)ethyl]methanesulfonamide
CID 154705131
1-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]-3-propylurea
CID 110747837
N-methyl-2-(4-methyl-1,3-thiazol-5-yl)-N-[(4-methyl-1,3-thiazol-5-yl)methyl]ethanamine
CID 134709892

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide?
The IUPAC name of N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide (CID 110718462) is N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide?
The canonical SMILES for N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide is Cc1ncsc1CCNS(C)(=O)=O.
What is the InChIKey of N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide?
The InChIKey is WIMJFQXINZFDAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2S2/c1-6-7(12-5-8-6)3-4-9-13(2,10)11/h5,9H,3-4H2,1-2H3.
What are the key properties of N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide?
N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide has a molecular weight of 220.32 g/mol, XLogP of 0.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methyl-1,3-thiazol-5-yl)ethyl]methanesulfonamide is sourced from PubChem (CID 110718462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).