N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide

C7H7F3N2O2S — CID 86794022

IUPACN-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1cccc(C(F)(F)F)n1
InChIInChI=1S/C7H7F3N2O2S/c1-15(13,14)12-6-4-2-3-5(11-6)7(8,9)10/h2-4H,1H3,(H,11,12)
InChIKeyWDNXKMQVIYDONO-UHFFFAOYSA-N
MW240.21 g/mol
LogP1.47
Rot. Bonds2

About N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide

N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide (PubChem CID 86794022) has the molecular formula C7H7F3N2O2S and a molecular weight of 240.21 g/mol. Its IUPAC name is N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide.

Molecular Properties

Compound NameN-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide
PubChem CID86794022
Molecular FormulaC7H7F3N2O2S
Molecular Weight240.21 g/mol
Exact Mass240.02
IUPAC NameN-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide
SMILESCS(=O)(=O)Nc1cccc(C(F)(F)F)n1
InChIInChI=1S/C7H7F3N2O2S/c1-15(13,14)12-6-4-2-3-5(11-6)7(8,9)10/h2-4H,1H3,(H,11,12)
InChIKeyWDNXKMQVIYDONO-UHFFFAOYSA-N
XLogP1.47
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.21
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide?
The IUPAC name of N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide (CID 86794022) is N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide.
What is the SMILES notation for N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide?
The canonical SMILES for N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide is CS(=O)(=O)Nc1cccc(C(F)(F)F)n1.
What is the InChIKey of N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide?
The InChIKey is WDNXKMQVIYDONO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2O2S/c1-15(13,14)12-6-4-2-3-5(11-6)7(8,9)10/h2-4H,1H3,(H,11,12).
What are the key properties of N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide?
N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide has a molecular weight of 240.21 g/mol, XLogP of 1.47, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(trifluoromethyl)-2-pyridinyl]methanesulfonamide is sourced from PubChem (CID 86794022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).