N,N,5-trimethylpyridine-2-sulfonamide

C8H12N2O2S — CID 71646856

IUPACN,N,5-trimethylpyridine-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)N(C)C)nc1
InChIInChI=1S/C8H12N2O2S/c1-7-4-5-8(9-6-7)13(11,12)10(2)3/h4-6H,1-3H3
InChIKeyTXYNXLQOQQDTFL-UHFFFAOYSA-N
MW200.26 g/mol
LogP0.64
Rot. Bonds2

About N,N,5-trimethylpyridine-2-sulfonamide

N,N,5-trimethylpyridine-2-sulfonamide (PubChem CID 71646856) has the molecular formula C8H12N2O2S and a molecular weight of 200.26 g/mol. Its IUPAC name is N,N,5-trimethylpyridine-2-sulfonamide.

Molecular Properties

Compound NameN,N,5-trimethylpyridine-2-sulfonamide
PubChem CID71646856
Molecular FormulaC8H12N2O2S
Molecular Weight200.26 g/mol
Exact Mass200.06
IUPAC NameN,N,5-trimethylpyridine-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)N(C)C)nc1
InChIInChI=1S/C8H12N2O2S/c1-7-4-5-8(9-6-7)13(11,12)10(2)3/h4-6H,1-3H3
InChIKeyTXYNXLQOQQDTFL-UHFFFAOYSA-N
XLogP0.64
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.26
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N,5-trimethylpyridine-2-sulfonamide?
The IUPAC name of N,N,5-trimethylpyridine-2-sulfonamide (CID 71646856) is N,N,5-trimethylpyridine-2-sulfonamide.
What is the SMILES notation for N,N,5-trimethylpyridine-2-sulfonamide?
The canonical SMILES for N,N,5-trimethylpyridine-2-sulfonamide is Cc1ccc(S(=O)(=O)N(C)C)nc1.
What is the InChIKey of N,N,5-trimethylpyridine-2-sulfonamide?
The InChIKey is TXYNXLQOQQDTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O2S/c1-7-4-5-8(9-6-7)13(11,12)10(2)3/h4-6H,1-3H3.
What are the key properties of N,N,5-trimethylpyridine-2-sulfonamide?
N,N,5-trimethylpyridine-2-sulfonamide has a molecular weight of 200.26 g/mol, XLogP of 0.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,5-trimethylpyridine-2-sulfonamide is sourced from PubChem (CID 71646856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).