4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine

C17H19NO4S — CID 2190649

IUPAC4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine
SMILESCOc1ccc(-c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C17H19NO4S/c1-21-16-6-2-14(3-7-16)15-4-8-17(9-5-15)23(19,20)18-10-12-22-13-11-18/h2-9H,10-13H2,1H3
InChIKeyOGZYTUAGONPHMU-UHFFFAOYSA-N
MW333.41 g/mol
LogP2.38
Rot. Bonds4

About 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine

4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine (PubChem CID 2190649) has the molecular formula C17H19NO4S and a molecular weight of 333.41 g/mol. Its IUPAC name is 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine.

Molecular Properties

Compound Name4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine
PubChem CID2190649
Molecular FormulaC17H19NO4S
Molecular Weight333.41 g/mol
Exact Mass333.10
IUPAC Name4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine
SMILESCOc1ccc(-c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1
InChIInChI=1S/C17H19NO4S/c1-21-16-6-2-14(3-7-16)15-4-8-17(9-5-15)23(19,20)18-10-12-22-13-11-18/h2-9H,10-13H2,1H3
InChIKeyOGZYTUAGONPHMU-UHFFFAOYSA-N
XLogP2.38
TPSA55.84 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.41
LogP ≤ 52.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-Ethoxynaphthalen-2-yl)sulfonylpiperidine
CID 786091
1-[(6-Methoxy-2-naphthyl)sulfonyl]-4-methylpiperazine
CID 775829
2-(4''-Methoxy-biphenyl-4-sulfonylamino)-6-morpholin-4-yl-hex-4-ynoic acid
CID 10504081
1'-((4'-Methoxy-[1,1'-biphenyl]-4-yl)sulfonyl)-4-methyl-1,4'-bipiperidine
CID 118308435
N-{[4-(4-methoxyphenyl)tetrahydro-2H-pyran-4-yl]methyl}benzenesulfonamide
CID 1293621
4-[(6-Ethoxy-2-naphthyl)sulfonyl]morpholine
CID 786092
4-(2-Ethoxy-5-propan-2-ylphenyl)sulfonylmorpholine
CID 850074
4-[(2-Ethoxy-5-isopropyl-4-methylphenyl)sulfonyl]morpholine
CID 935156
Phenyl 3-(4-morpholin-4-ylsulfonylphenyl)propanoate
CID 2572948
1-(4-Methylphenyl)sulfonyl-4-(2-phenoxyethyl)piperazine
CID 2747482
4-[(5-Tert-butyl-2-ethoxyphenyl)sulfonyl]-2,6-dimethylmorpholine
CID 2968838
1-[(4-Methoxyphenyl)methoxy]-3-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]propan-2-ol
CID 16230928

Frequently Asked Questions

What is the IUPAC name of 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine?
The IUPAC name of 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine (CID 2190649) is 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine.
What is the SMILES notation for 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine?
The canonical SMILES for 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine is COc1ccc(-c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1.
What is the InChIKey of 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine?
The InChIKey is OGZYTUAGONPHMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO4S/c1-21-16-6-2-14(3-7-16)15-4-8-17(9-5-15)23(19,20)18-10-12-22-13-11-18/h2-9H,10-13H2,1H3.
What are the key properties of 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine?
4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine has a molecular weight of 333.41 g/mol, XLogP of 2.38, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(4-methoxyphenyl)phenyl]sulfonylmorpholine is sourced from PubChem (CID 2190649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).