N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide

C11H15N3O2S2 — CID 155911897

IUPACN-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide
SMILESCc1ccc(-c2nccn2CCNS(C)(=O)=O)s1
InChIInChI=1S/C11H15N3O2S2/c1-9-3-4-10(17-9)11-12-5-7-14(11)8-6-13-18(2,15)16/h3-5,7,13H,6,8H2,1-2H3
InChIKeyWYDXKLQPPGGPQA-UHFFFAOYSA-N
MW285.39 g/mol
LogP1.47
Rot. Bonds5

About N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide

N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide (PubChem CID 155911897) has the molecular formula C11H15N3O2S2 and a molecular weight of 285.39 g/mol. Its IUPAC name is N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide
PubChem CID155911897
Molecular FormulaC11H15N3O2S2
Molecular Weight285.39 g/mol
Exact Mass285.06
IUPAC NameN-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide
SMILESCc1ccc(-c2nccn2CCNS(C)(=O)=O)s1
InChIInChI=1S/C11H15N3O2S2/c1-9-3-4-10(17-9)11-12-5-7-14(11)8-6-13-18(2,15)16/h3-5,7,13H,6,8H2,1-2H3
InChIKeyWYDXKLQPPGGPQA-UHFFFAOYSA-N
XLogP1.47
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide?
The IUPAC name of N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide (CID 155911897) is N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide.
What is the SMILES notation for N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide?
The canonical SMILES for N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide is Cc1ccc(-c2nccn2CCNS(C)(=O)=O)s1.
What is the InChIKey of N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide?
The InChIKey is WYDXKLQPPGGPQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2S2/c1-9-3-4-10(17-9)11-12-5-7-14(11)8-6-13-18(2,15)16/h3-5,7,13H,6,8H2,1-2H3.
What are the key properties of N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide?
N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide has a molecular weight of 285.39 g/mol, XLogP of 1.47, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(5-methylthiophen-2-yl)imidazol-1-yl]ethyl]methanesulfonamide is sourced from PubChem (CID 155911897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).