N,4-dibutyl-N-methylbenzenesulfonamide

C15H25NO2S — CID 3736049

IUPACN,4-dibutyl-N-methylbenzenesulfonamide
SMILESCCCCc1ccc(S(=O)(=O)N(C)CCCC)cc1
InChIInChI=1S/C15H25NO2S/c1-4-6-8-14-9-11-15(12-10-14)19(17,18)16(3)13-7-5-2/h9-12H,4-8,13H2,1-3H3
InChIKeyUQRFTDHITOAXAJ-UHFFFAOYSA-N
MW283.44 g/mol
LogP3.45
Rot. Bonds8

About N,4-dibutyl-N-methylbenzenesulfonamide

N,4-dibutyl-N-methylbenzenesulfonamide (PubChem CID 3736049) has the molecular formula C15H25NO2S and a molecular weight of 283.44 g/mol. Its IUPAC name is N,4-dibutyl-N-methylbenzenesulfonamide.

Molecular Properties

Compound NameN,4-dibutyl-N-methylbenzenesulfonamide
PubChem CID3736049
Molecular FormulaC15H25NO2S
Molecular Weight283.44 g/mol
Exact Mass283.16
IUPAC NameN,4-dibutyl-N-methylbenzenesulfonamide
SMILESCCCCc1ccc(S(=O)(=O)N(C)CCCC)cc1
InChIInChI=1S/C15H25NO2S/c1-4-6-8-14-9-11-15(12-10-14)19(17,18)16(3)13-7-5-2/h9-12H,4-8,13H2,1-3H3
InChIKeyUQRFTDHITOAXAJ-UHFFFAOYSA-N
XLogP3.45
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.44
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-4-iodo-N-methylbenzenesulfonamide
CID 4992197
N-butyl-4-[butyl(methyl)sulfamoyl]-N-methylbenzamide
CID 109061421
N-butyl-4-(1-hydroxyethyl)-N-methylbenzenesulfonamide
CID 43507359
N-methyl-N-(5-phenylpentyl)benzenesulfonamide
CID 22024838
4-butyl-N-[(1-ethylpyrazol-4-yl)methyl]-N-methylbenzenesulfonamide
CID 22204130
4-(aminomethyl)-N-[3-(dimethylamino)propyl]-N-methylbenzenesulfonamide
CID 55225592
4-bromo-N-butyl-N,3-dimethylbenzenesulfonamide
CID 54917653
N-methoxy-N-methyl-4-propylbenzenesulfonamide
CID 60660891
3-[butyl(methyl)sulfamoyl]benzenesulfonyl fluoride
CID 114791217
4-butyl-N-[3-(dimethylamino)propyl]benzenesulfonamide
CID 19681719
2-[(4-butylphenyl)sulfonyl-pentylamino]-N-hydroxyacetamide
CID 142683333
1-N,3-N-dimethyl-1-N,3-N-dioctadecylbenzene-1,3-disulfonamide
CID 168911420

Frequently Asked Questions

What is the IUPAC name of N,4-dibutyl-N-methylbenzenesulfonamide?
The IUPAC name of N,4-dibutyl-N-methylbenzenesulfonamide (CID 3736049) is N,4-dibutyl-N-methylbenzenesulfonamide.
What is the SMILES notation for N,4-dibutyl-N-methylbenzenesulfonamide?
The canonical SMILES for N,4-dibutyl-N-methylbenzenesulfonamide is CCCCc1ccc(S(=O)(=O)N(C)CCCC)cc1.
What is the InChIKey of N,4-dibutyl-N-methylbenzenesulfonamide?
The InChIKey is UQRFTDHITOAXAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2S/c1-4-6-8-14-9-11-15(12-10-14)19(17,18)16(3)13-7-5-2/h9-12H,4-8,13H2,1-3H3.
What are the key properties of N,4-dibutyl-N-methylbenzenesulfonamide?
N,4-dibutyl-N-methylbenzenesulfonamide has a molecular weight of 283.44 g/mol, XLogP of 3.45, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dibutyl-N-methylbenzenesulfonamide is sourced from PubChem (CID 3736049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).