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

C8H14N2O2S2 — CID 71997185

IUPACN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide
SMILESCCc1cnc(CCNS(C)(=O)=O)s1
InChIInChI=1S/C8H14N2O2S2/c1-3-7-6-9-8(13-7)4-5-10-14(2,11)12/h6,10H,3-5H2,1-2H3
InChIKeyQYWDKAMGKWTSFN-UHFFFAOYSA-N
MW234.35 g/mol
LogP0.80
Rot. Bonds5

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

N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide (PubChem CID 71997185) has the molecular formula C8H14N2O2S2 and a molecular weight of 234.35 g/mol. Its IUPAC name is N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide
PubChem CID71997185
Molecular FormulaC8H14N2O2S2
Molecular Weight234.35 g/mol
Exact Mass234.05
IUPAC NameN-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide
SMILESCCc1cnc(CCNS(C)(=O)=O)s1
InChIInChI=1S/C8H14N2O2S2/c1-3-7-6-9-8(13-7)4-5-10-14(2,11)12/h6,10H,3-5H2,1-2H3
InChIKeyQYWDKAMGKWTSFN-UHFFFAOYSA-N
XLogP0.80
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.35
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide?
The IUPAC name of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide (CID 71997185) is N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide?
The canonical SMILES for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide is CCc1cnc(CCNS(C)(=O)=O)s1.
What is the InChIKey of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide?
The InChIKey is QYWDKAMGKWTSFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2O2S2/c1-3-7-6-9-8(13-7)4-5-10-14(2,11)12/h6,10H,3-5H2,1-2H3.
What are the key properties of N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide?
N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide has a molecular weight of 234.35 g/mol, XLogP of 0.80, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-ethyl-1,3-thiazol-2-yl)ethyl]methanesulfonamide is sourced from PubChem (CID 71997185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).