2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide

C14H22N2O4S — CID 747985

IUPAC2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide
SMILESCOc1ccc(C)cc1S(=O)(=O)NCCN1CCOCC1
InChIInChI=1S/C14H22N2O4S/c1-12-3-4-13(19-2)14(11-12)21(17,18)15-5-6-16-7-9-20-10-8-16/h3-4,11,15H,5-10H2,1-2H3
InChIKeyWJVDUTPFILODHK-UHFFFAOYSA-N
MW314.41 g/mol
LogP0.61
Rot. Bonds6

About 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide

2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide (PubChem CID 747985) has the molecular formula C14H22N2O4S and a molecular weight of 314.41 g/mol. Its IUPAC name is 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide.

Molecular Properties

Compound Name2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide
PubChem CID747985
Molecular FormulaC14H22N2O4S
Molecular Weight314.41 g/mol
Exact Mass314.13
IUPAC Name2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide
SMILESCOc1ccc(C)cc1S(=O)(=O)NCCN1CCOCC1
InChIInChI=1S/C14H22N2O4S/c1-12-3-4-13(19-2)14(11-12)21(17,18)15-5-6-16-7-9-20-10-8-16/h3-4,11,15H,5-10H2,1-2H3
InChIKeyWJVDUTPFILODHK-UHFFFAOYSA-N
XLogP0.61
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.41
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Fluoro-2-methoxy-N-(2-morpholin-4-yl-ethyl)-benzenesulfonamide
CID 6487446
1-[(4-Methoxy-3-methylphenyl)sulfonyl]-4-methylpiperazine
CID 847009
1,4-Bis[(2-methoxy-5-methylphenyl)sulfonyl]-2-methylpiperazine
CID 2897110
MicroRNA modulator-1
CID 5967303
1-(2-Methoxy-5-methyl-benzenesulfonyl)-4-methyl-piperidine
CID 646254
1-((5-Isopropyl-2-methoxyphenyl)sulfonyl)-4-methylpiperazine
CID 650490
4-(2-Ethoxy-5-propan-2-ylphenyl)sulfonylmorpholine
CID 850074
N-cyclohexyl-2-ethoxy-5-methylbenzenesulfonamide
CID 850126
1-(5-Tert-butyl-2-methoxyphenyl)sulfonyl-4-methylpiperazine
CID 934666
N-[2-(1-cyclohexen-1-yl)ethyl]-2-methoxy-5-methylbenzenesulfonamide
CID 967893
2-Methoxy-5,N-dimethyl-N-[2-(4-methyl-piperazin-1-yl)-2-oxo-ethyl]-benzenesulfonamide
CID 1095811
5-ethoxy-2,4-dimethyl-N-[2-(4-morpholinyl)ethyl]benzenesulfonamide
CID 1256749

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide?
The IUPAC name of 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide (CID 747985) is 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide.
What is the SMILES notation for 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide?
The canonical SMILES for 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide is COc1ccc(C)cc1S(=O)(=O)NCCN1CCOCC1.
What is the InChIKey of 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide?
The InChIKey is WJVDUTPFILODHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4S/c1-12-3-4-13(19-2)14(11-12)21(17,18)15-5-6-16-7-9-20-10-8-16/h3-4,11,15H,5-10H2,1-2H3.
What are the key properties of 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide?
2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide has a molecular weight of 314.41 g/mol, XLogP of 0.61, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-methyl-N-(2-morpholin-4-ylethyl)benzenesulfonamide is sourced from PubChem (CID 747985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).