N-(thiophen-2-ylmethyl)methanesulfonamide

C6H9NO2S2 — CID 2820602

IUPACN-(thiophen-2-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)NCc1cccs1
InChIInChI=1S/C6H9NO2S2/c1-11(8,9)7-5-6-3-2-4-10-6/h2-4,7H,5H2,1H3
InChIKeyBXQVPYPFMGGFNE-UHFFFAOYSA-N
MW191.28 g/mol
LogP0.80
Rot. Bonds3

About N-(thiophen-2-ylmethyl)methanesulfonamide

N-(thiophen-2-ylmethyl)methanesulfonamide (PubChem CID 2820602) has the molecular formula C6H9NO2S2 and a molecular weight of 191.28 g/mol. Its IUPAC name is N-(thiophen-2-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-(thiophen-2-ylmethyl)methanesulfonamide
PubChem CID2820602
Molecular FormulaC6H9NO2S2
Molecular Weight191.28 g/mol
Exact Mass191.01
IUPAC NameN-(thiophen-2-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)NCc1cccs1
InChIInChI=1S/C6H9NO2S2/c1-11(8,9)7-5-6-3-2-4-10-6/h2-4,7H,5H2,1H3
InChIKeyBXQVPYPFMGGFNE-UHFFFAOYSA-N
XLogP0.80
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 50.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(thiophen-2-ylmethyl)methanesulfonamide?
The IUPAC name of N-(thiophen-2-ylmethyl)methanesulfonamide (CID 2820602) is N-(thiophen-2-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-(thiophen-2-ylmethyl)methanesulfonamide?
The canonical SMILES for N-(thiophen-2-ylmethyl)methanesulfonamide is CS(=O)(=O)NCc1cccs1.
What is the InChIKey of N-(thiophen-2-ylmethyl)methanesulfonamide?
The InChIKey is BXQVPYPFMGGFNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2S2/c1-11(8,9)7-5-6-3-2-4-10-6/h2-4,7H,5H2,1H3.
What are the key properties of N-(thiophen-2-ylmethyl)methanesulfonamide?
N-(thiophen-2-ylmethyl)methanesulfonamide has a molecular weight of 191.28 g/mol, XLogP of 0.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(thiophen-2-ylmethyl)methanesulfonamide is sourced from PubChem (CID 2820602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).