4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide

C18H23NO3S — CID 142273724

IUPAC4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide
SMILESCCCc1ccc(OC)c(NS(=O)(=O)c2ccc(CC)cc2)c1
InChIInChI=1S/C18H23NO3S/c1-4-6-15-9-12-18(22-3)17(13-15)19-23(20,21)16-10-7-14(5-2)8-11-16/h7-13,19H,4-6H2,1-3H3
InChIKeyNNQJTXSAFDMPHD-UHFFFAOYSA-N
MW333.45 g/mol
LogP4.01
Rot. Bonds7

About 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide

4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide (PubChem CID 142273724) has the molecular formula C18H23NO3S and a molecular weight of 333.45 g/mol. Its IUPAC name is 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide.

Molecular Properties

Compound Name4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide
PubChem CID142273724
Molecular FormulaC18H23NO3S
Molecular Weight333.45 g/mol
Exact Mass333.14
IUPAC Name4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide
SMILESCCCc1ccc(OC)c(NS(=O)(=O)c2ccc(CC)cc2)c1
InChIInChI=1S/C18H23NO3S/c1-4-6-15-9-12-18(22-3)17(13-15)19-23(20,21)16-10-7-14(5-2)8-11-16/h7-13,19H,4-6H2,1-3H3
InChIKeyNNQJTXSAFDMPHD-UHFFFAOYSA-N
XLogP4.01
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.45
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[3-[(4-ethylphenyl)sulfonylamino]-4-methoxyphenyl]acetamide
CID 4149127
N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-4-ethylbenzenesulfonamide
CID 29099743
N-(4-ethylphenyl)-4-propylbenzenesulfonamide
CID 22773839
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-propylbenzenesulfonamide
CID 19680884
4-(aminomethyl)-N-(2,5-dimethoxyphenyl)benzenesulfonamide;hydrochloride
CID 172999625
4-butyl-N-(4-chloro-2,5-dimethoxyphenyl)benzenesulfonamide
CID 22774048
N-(5-ethyl-2-methoxyphenyl)-2-oxo-1,3-dihydroindole-5-sulfonamide
CID 110777264
N-[4-methoxy-3-(trifluoromethyl)phenyl]-4-propylbenzenesulfonamide
CID 3374845
N-[2-(difluoromethoxy)-5-methylphenyl]-4-ethylbenzenesulfonamide
CID 19684057
4-chloro-N-(5-fluoro-2-methoxyphenyl)benzenesulfonamide
CID 110776607
3-[3-(furan-3-ylsulfonylamino)-4-methoxyphenyl]propanoic acid
CID 136541728
N-(5-ethyl-2-methoxyphenyl)-1-phenylmethanesulfonamide
CID 110777258

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide?
The IUPAC name of 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide (CID 142273724) is 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide.
What is the SMILES notation for 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide?
The canonical SMILES for 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide is CCCc1ccc(OC)c(NS(=O)(=O)c2ccc(CC)cc2)c1.
What is the InChIKey of 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide?
The InChIKey is NNQJTXSAFDMPHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO3S/c1-4-6-15-9-12-18(22-3)17(13-15)19-23(20,21)16-10-7-14(5-2)8-11-16/h7-13,19H,4-6H2,1-3H3.
What are the key properties of 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide?
4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide has a molecular weight of 333.45 g/mol, XLogP of 4.01, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-(2-methoxy-5-propylphenyl)benzenesulfonamide is sourced from PubChem (CID 142273724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).