4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine

C18H29N3O5S — CID 113073742

IUPAC4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine
SMILESCOc1ccc(S(=O)(=O)N2CCN(CCN3CCOCC3)CC2)c(OC)c1
InChIInChI=1S/C18H29N3O5S/c1-24-16-3-4-18(17(15-16)25-2)27(22,23)21-9-7-19(8-10-21)5-6-20-11-13-26-14-12-20/h3-4,15H,5-14H2,1-2H3
InChIKeyUJBXCRNKGVZHAW-UHFFFAOYSA-N
MW399.51 g/mol
LogP0.34
Rot. Bonds7

About 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine

4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine (PubChem CID 113073742) has the molecular formula C18H29N3O5S and a molecular weight of 399.51 g/mol. Its IUPAC name is 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine.

Molecular Properties

Compound Name4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine
PubChem CID113073742
Molecular FormulaC18H29N3O5S
Molecular Weight399.51 g/mol
Exact Mass399.18
IUPAC Name4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine
SMILESCOc1ccc(S(=O)(=O)N2CCN(CCN3CCOCC3)CC2)c(OC)c1
InChIInChI=1S/C18H29N3O5S/c1-24-16-3-4-18(17(15-16)25-2)27(22,23)21-9-7-19(8-10-21)5-6-20-11-13-26-14-12-20/h3-4,15H,5-14H2,1-2H3
InChIKeyUJBXCRNKGVZHAW-UHFFFAOYSA-N
XLogP0.34
TPSA71.55 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.51
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2,4-dimethoxyphenyl)sulfonyl-4-(4-methoxyphenyl)sulfonylpiperazine
CID 19684107
1-butan-2-yl-4-(2,4-dimethoxyphenyl)sulfonylpiperazine
CID 113072995
1-cyclopropyl-4-(2,4-dimethoxyphenyl)sulfonylpiperazine
CID 110708580
1-(2,4-dimethoxyphenyl)sulfonyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazine
CID 22208305
[1-(2,4-dimethoxyphenyl)sulfonylpiperidin-4-yl]methanamine
CID 43605335
4-(2,5-dimethoxyphenyl)sulfonyl-1,4-oxazepane
CID 4987826
ethyl 4-(2,4-dimethoxyphenyl)sulfonylpiperazine-1-carboxylate
CID 91669968
1-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2,2-dimethylpropan-1-one
CID 110817974
1-(2,5-dimethoxyphenyl)sulfonyl-4-[2-(4-methylphenoxy)ethyl]piperazine
CID 8804090
2,5-dimethoxy-N-(2-morpholin-4-ylethoxy)benzenesulfonamide
CID 110642838
1-(2,5-dimethoxyphenyl)sulfonyl-4-(2-thiophen-2-ylethyl)piperazine
CID 3836701
4-(2,4-dimethoxyphenyl)sulfonyl-2,6-dimethylmorpholine
CID 19682685

Frequently Asked Questions

What is the IUPAC name of 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine?
The IUPAC name of 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine (CID 113073742) is 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine.
What is the SMILES notation for 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine?
The canonical SMILES for 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine is COc1ccc(S(=O)(=O)N2CCN(CCN3CCOCC3)CC2)c(OC)c1.
What is the InChIKey of 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine?
The InChIKey is UJBXCRNKGVZHAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3O5S/c1-24-16-3-4-18(17(15-16)25-2)27(22,23)21-9-7-19(8-10-21)5-6-20-11-13-26-14-12-20/h3-4,15H,5-14H2,1-2H3.
What are the key properties of 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine?
4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine has a molecular weight of 399.51 g/mol, XLogP of 0.34, 7 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[4-(2,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]morpholine is sourced from PubChem (CID 113073742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).