4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide

C15H17NO4S — CID 62337650

IUPAC4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide
SMILESCCOc1cccc(Oc2ccc(S(N)(=O)=O)c(C)c2)c1
InChIInChI=1S/C15H17NO4S/c1-3-19-12-5-4-6-13(10-12)20-14-7-8-15(11(2)9-14)21(16,17)18/h4-10H,3H2,1-2H3,(H2,16,17,18)
InChIKeyFPQLGVSRWHNGRN-UHFFFAOYSA-N
MW307.37 g/mol
LogP2.83
Rot. Bonds5

About 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide

4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide (PubChem CID 62337650) has the molecular formula C15H17NO4S and a molecular weight of 307.37 g/mol. Its IUPAC name is 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide.

Molecular Properties

Compound Name4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide
PubChem CID62337650
Molecular FormulaC15H17NO4S
Molecular Weight307.37 g/mol
Exact Mass307.09
IUPAC Name4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide
SMILESCCOc1cccc(Oc2ccc(S(N)(=O)=O)c(C)c2)c1
InChIInChI=1S/C15H17NO4S/c1-3-19-12-5-4-6-13(10-12)20-14-7-8-15(11(2)9-14)21(16,17)18/h4-10H,3H2,1-2H3,(H2,16,17,18)
InChIKeyFPQLGVSRWHNGRN-UHFFFAOYSA-N
XLogP2.83
TPSA78.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(3,4-dimethylphenoxy)-2-methylbenzenesulfonamide
CID 43436537
4-[3-(methoxymethyl)phenoxy]-2-methylbenzenesulfonamide
CID 63985143
4-(2-fluoroethoxy)-2-methylbenzenesulfonamide
CID 80694123
2-ethoxy-5-phenoxybenzenesulfonamide
CID 155234436
4-(4-cyanophenoxy)-2-methylbenzenesulfonamide
CID 43436544
4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide
CID 43436547
4-(2,3-dihydro-1H-inden-5-yloxy)-2-methylbenzenesulfonamide
CID 43436560
4-[(E)-3-chloroprop-2-enoxy]-2-methylbenzenesulfonamide
CID 82914363
2-amino-4-(3-methoxyphenoxy)benzenesulfonamide
CID 79467005
2-methyl-4-(2-pyridin-3-ylethoxy)benzenesulfonamide
CID 82914505
4-(4-cyanobutoxy)-2-methylbenzenesulfonamide
CID 82914658
N-butyl-2-(3-methyl-4-sulfamoylphenoxy)acetamide
CID 82914364

Frequently Asked Questions

What is the IUPAC name of 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide?
The IUPAC name of 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide (CID 62337650) is 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide.
What is the SMILES notation for 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide?
The canonical SMILES for 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide is CCOc1cccc(Oc2ccc(S(N)(=O)=O)c(C)c2)c1.
What is the InChIKey of 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide?
The InChIKey is FPQLGVSRWHNGRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO4S/c1-3-19-12-5-4-6-13(10-12)20-14-7-8-15(11(2)9-14)21(16,17)18/h4-10H,3H2,1-2H3,(H2,16,17,18).
What are the key properties of 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide?
4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide has a molecular weight of 307.37 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethoxyphenoxy)-2-methylbenzenesulfonamide is sourced from PubChem (CID 62337650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).