N,N,2,5-tetramethylbenzenesulfonamide

C10H15NO2S — CID 16644738

IUPACN,N,2,5-tetramethylbenzenesulfonamide
SMILESCc1ccc(C)c(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C10H15NO2S/c1-8-5-6-9(2)10(7-8)14(12,13)11(3)4/h5-7H,1-4H3
InChIKeyLLGUBNPYANMOBH-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.55
Rot. Bonds2

About N,N,2,5-tetramethylbenzenesulfonamide

N,N,2,5-tetramethylbenzenesulfonamide (PubChem CID 16644738) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is N,N,2,5-tetramethylbenzenesulfonamide.

Molecular Properties

Compound NameN,N,2,5-tetramethylbenzenesulfonamide
PubChem CID16644738
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC NameN,N,2,5-tetramethylbenzenesulfonamide
SMILESCc1ccc(C)c(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C10H15NO2S/c1-8-5-6-9(2)10(7-8)14(12,13)11(3)4/h5-7H,1-4H3
InChIKeyLLGUBNPYANMOBH-UHFFFAOYSA-N
XLogP1.55
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N,N,2,5-tetramethylbenzenesulfonamide?
The IUPAC name of N,N,2,5-tetramethylbenzenesulfonamide (CID 16644738) is N,N,2,5-tetramethylbenzenesulfonamide.
What is the SMILES notation for N,N,2,5-tetramethylbenzenesulfonamide?
The canonical SMILES for N,N,2,5-tetramethylbenzenesulfonamide is Cc1ccc(C)c(S(=O)(=O)N(C)C)c1.
What is the InChIKey of N,N,2,5-tetramethylbenzenesulfonamide?
The InChIKey is LLGUBNPYANMOBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-8-5-6-9(2)10(7-8)14(12,13)11(3)4/h5-7H,1-4H3.
What are the key properties of N,N,2,5-tetramethylbenzenesulfonamide?
N,N,2,5-tetramethylbenzenesulfonamide has a molecular weight of 213.30 g/mol, XLogP of 1.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N,2,5-tetramethylbenzenesulfonamide is sourced from PubChem (CID 16644738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).