N,4-diethyl-N-methylbenzenesulfonamide

C11H17NO2S — CID 142914245

IUPACN,4-diethyl-N-methylbenzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)N(C)CC)cc1
InChIInChI=1S/C11H17NO2S/c1-4-10-6-8-11(9-7-10)15(13,14)12(3)5-2/h6-9H,4-5H2,1-3H3
InChIKeyLTQLPABZTWJHGY-UHFFFAOYSA-N
MW227.33 g/mol
LogP1.89
Rot. Bonds4

About N,4-diethyl-N-methylbenzenesulfonamide

N,4-diethyl-N-methylbenzenesulfonamide (PubChem CID 142914245) has the molecular formula C11H17NO2S and a molecular weight of 227.33 g/mol. Its IUPAC name is N,4-diethyl-N-methylbenzenesulfonamide.

Molecular Properties

Compound NameN,4-diethyl-N-methylbenzenesulfonamide
PubChem CID142914245
Molecular FormulaC11H17NO2S
Molecular Weight227.33 g/mol
Exact Mass227.10
IUPAC NameN,4-diethyl-N-methylbenzenesulfonamide
SMILESCCc1ccc(S(=O)(=O)N(C)CC)cc1
InChIInChI=1S/C11H17NO2S/c1-4-10-6-8-11(9-7-10)15(13,14)12(3)5-2/h6-9H,4-5H2,1-3H3
InChIKeyLTQLPABZTWJHGY-UHFFFAOYSA-N
XLogP1.89
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.33
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-N-methyl-4-(methylaminomethyl)benzenesulfonamide
CID 60824654
2-[4-[ethyl(methyl)sulfamoyl]phenyl]ethanethioamide
CID 79186028
N-(2,3-dihydroxypropyl)-4-ethyl-N-methylbenzenesulfonamide
CID 4985580
N-ethyl-4-(ethylamino)-N-methylbenzenesulfonamide
CID 62144614
N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-ethyl-N-methylbenzenesulfonamide
CID 18191917
4-bromo-N-(4-ethylphenyl)-N-methylbenzenesulfonamide
CID 62001773
4-ethyl-N,N-bis(2-methylpropyl)benzenesulfonamide
CID 19682262
1-ethyl-4-methylsulfonylbenzene
CID 143759723
N-cyclopropyl-2-[(4-ethylphenyl)sulfonyl-methylamino]acetamide
CID 8816780
2-[(4-ethylphenyl)sulfonyl-methylamino]-N-(4-methylphenyl)acetamide
CID 40735304
calcium bis(4-ethylbenzenesulfonate)
CID 87263292
4-ethyl-N-methyl-N-(1-methylpiperidin-4-yl)benzenesulfonamide
CID 57393432

Frequently Asked Questions

What is the IUPAC name of N,4-diethyl-N-methylbenzenesulfonamide?
The IUPAC name of N,4-diethyl-N-methylbenzenesulfonamide (CID 142914245) is N,4-diethyl-N-methylbenzenesulfonamide.
What is the SMILES notation for N,4-diethyl-N-methylbenzenesulfonamide?
The canonical SMILES for N,4-diethyl-N-methylbenzenesulfonamide is CCc1ccc(S(=O)(=O)N(C)CC)cc1.
What is the InChIKey of N,4-diethyl-N-methylbenzenesulfonamide?
The InChIKey is LTQLPABZTWJHGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2S/c1-4-10-6-8-11(9-7-10)15(13,14)12(3)5-2/h6-9H,4-5H2,1-3H3.
What are the key properties of N,4-diethyl-N-methylbenzenesulfonamide?
N,4-diethyl-N-methylbenzenesulfonamide has a molecular weight of 227.33 g/mol, XLogP of 1.89, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-diethyl-N-methylbenzenesulfonamide is sourced from PubChem (CID 142914245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).