4-ethyl-2,5-dimethylbenzenesulfonamide

C10H15NO2S — CID 58979780

IUPAC4-ethyl-2,5-dimethylbenzenesulfonamide
SMILESCCc1cc(C)c(S(N)(=O)=O)cc1C
InChIInChI=1S/C10H15NO2S/c1-4-9-5-8(3)10(6-7(9)2)14(11,12)13/h5-6H,4H2,1-3H3,(H2,11,12,13)
InChIKeyDTGBYPZXDXHVAS-UHFFFAOYSA-N
MW213.30 g/mol
LogP1.51
Rot. Bonds2

About 4-ethyl-2,5-dimethylbenzenesulfonamide

4-ethyl-2,5-dimethylbenzenesulfonamide (PubChem CID 58979780) has the molecular formula C10H15NO2S and a molecular weight of 213.30 g/mol. Its IUPAC name is 4-ethyl-2,5-dimethylbenzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-2,5-dimethylbenzenesulfonamide
PubChem CID58979780
Molecular FormulaC10H15NO2S
Molecular Weight213.30 g/mol
Exact Mass213.08
IUPAC Name4-ethyl-2,5-dimethylbenzenesulfonamide
SMILESCCc1cc(C)c(S(N)(=O)=O)cc1C
InChIInChI=1S/C10H15NO2S/c1-4-9-5-8(3)10(6-7(9)2)14(11,12)13/h5-6H,4H2,1-3H3,(H2,11,12,13)
InChIKeyDTGBYPZXDXHVAS-UHFFFAOYSA-N
XLogP1.51
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.30
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,5-trimethylbenzenesulfonamide
CID 961422
5-ethyl-2,3-dimethylbenzenesulfonamide
CID 58109757
2,4-dimethyl-5-sulfanylbenzenesulfonamide
CID 67169814
4,5-dimethoxy-2-methylbenzenesulfonamide
CID 35299033
2,5-dimethyl-4-pentan-2-yloxybenzenesulfonamide
CID 107896256
5-chloro-4-ethoxy-2-methylbenzenesulfonamide
CID 82297288
4-(2-methoxyethoxy)-2,5-dimethylbenzenesulfonamide
CID 43164561
1-bromo-2-ethyl-4,5-dimethylbenzene
CID 90213759
4-ethyl-5-methylbenzene-1,2-diol
CID 66591490
2-methyl-4-(propylsulfonylamino)benzenesulfonamide
CID 43134191
2-methyl-4-(methylamino)benzenesulfonamide
CID 71282580
4-bromo-5-methoxy-2-methylbenzenesulfonamide
CID 154254262

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,5-dimethylbenzenesulfonamide?
The IUPAC name of 4-ethyl-2,5-dimethylbenzenesulfonamide (CID 58979780) is 4-ethyl-2,5-dimethylbenzenesulfonamide.
What is the SMILES notation for 4-ethyl-2,5-dimethylbenzenesulfonamide?
The canonical SMILES for 4-ethyl-2,5-dimethylbenzenesulfonamide is CCc1cc(C)c(S(N)(=O)=O)cc1C.
What is the InChIKey of 4-ethyl-2,5-dimethylbenzenesulfonamide?
The InChIKey is DTGBYPZXDXHVAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO2S/c1-4-9-5-8(3)10(6-7(9)2)14(11,12)13/h5-6H,4H2,1-3H3,(H2,11,12,13).
What are the key properties of 4-ethyl-2,5-dimethylbenzenesulfonamide?
4-ethyl-2,5-dimethylbenzenesulfonamide has a molecular weight of 213.30 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,5-dimethylbenzenesulfonamide is sourced from PubChem (CID 58979780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).