2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine

C19H22ClNO4S — CID 110327129

IUPAC2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine
SMILESCOc1cc(C)c(S(=O)(=O)N2CCOC(c3ccc(Cl)cc3)C2)cc1C
InChIInChI=1S/C19H22ClNO4S/c1-13-11-19(14(2)10-17(13)24-3)26(22,23)21-8-9-25-18(12-21)15-4-6-16(20)7-5-15/h4-7,10-11,18H,8-9,12H2,1-3H3
InChIKeyMRERIYWISJGHAD-UHFFFAOYSA-N
MW395.91 g/mol
LogP3.73
Rot. Bonds4

About 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine

2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine (PubChem CID 110327129) has the molecular formula C19H22ClNO4S and a molecular weight of 395.91 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine
PubChem CID110327129
Molecular FormulaC19H22ClNO4S
Molecular Weight395.91 g/mol
Exact Mass395.10
IUPAC Name2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine
SMILESCOc1cc(C)c(S(=O)(=O)N2CCOC(c3ccc(Cl)cc3)C2)cc1C
InChIInChI=1S/C19H22ClNO4S/c1-13-11-19(14(2)10-17(13)24-3)26(22,23)21-8-9-25-18(12-21)15-4-6-16(20)7-5-15/h4-7,10-11,18H,8-9,12H2,1-3H3
InChIKeyMRERIYWISJGHAD-UHFFFAOYSA-N
XLogP3.73
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.91
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine 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

4-(5-chloro-2-methoxyphenyl)sulfonyl-2-(4-fluorophenyl)morpholine
CID 110326818
(2S)-4-(2-methoxy-4,5-dimethylphenyl)sulfonyl-2-[4-(trifluoromethyl)phenyl]morpholine
CID 95366969
(2R)-4-(5-chloro-2-methoxyphenyl)sulfonyl-2-phenylmorpholine
CID 42109148
2-(4-methoxyphenyl)-4-(2-methylphenyl)sulfonylmorpholine
CID 110327287
4-(3,4-dimethylphenyl)sulfonyl-2-(4-methoxyphenyl)morpholine
CID 110327242
4-(2,5-dimethoxyphenyl)sulfonyl-2-(4-fluorophenyl)morpholine
CID 110326792
4-(2,5-dimethoxyphenyl)sulfonyl-2-(4-ethylphenyl)morpholine
CID 110364059
2-(4-chlorophenyl)-N,N-dimethylmorpholine-4-sulfonamide
CID 47320271
(2R)-2-(4-chlorophenyl)-4-(1,2-dimethylimidazol-4-yl)sulfonylmorpholine
CID 95167565
2-(3-chlorophenyl)-4-(3,4-dimethoxyphenyl)sulfonylmorpholine
CID 110327027
2-(4-fluorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonyl-1-methylpiperazine
CID 110418700
1-(4-methoxy-2,5-dimethylphenyl)sulfonyl-3-methylpiperidine
CID 3144185

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine?
The IUPAC name of 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine (CID 110327129) is 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine.
What is the SMILES notation for 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine?
The canonical SMILES for 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine is COc1cc(C)c(S(=O)(=O)N2CCOC(c3ccc(Cl)cc3)C2)cc1C.
What is the InChIKey of 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine?
The InChIKey is MRERIYWISJGHAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClNO4S/c1-13-11-19(14(2)10-17(13)24-3)26(22,23)21-8-9-25-18(12-21)15-4-6-16(20)7-5-15/h4-7,10-11,18H,8-9,12H2,1-3H3.
What are the key properties of 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine?
2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine has a molecular weight of 395.91 g/mol, XLogP of 3.73, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-4-(4-methoxy-2,5-dimethylphenyl)sulfonylmorpholine is sourced from PubChem (CID 110327129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).