2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine

C17H18FNO3S — CID 110326724

IUPAC2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine
SMILESCc1cccc(S(=O)(=O)N2CCOC(c3ccccc3F)C2)c1
InChIInChI=1S/C17H18FNO3S/c1-13-5-4-6-14(11-13)23(20,21)19-9-10-22-17(12-19)15-7-2-3-8-16(15)18/h2-8,11,17H,9-10,12H2,1H3
InChIKeyRLDXLNAFCKFFPN-UHFFFAOYSA-N
MW335.40 g/mol
LogP2.90
Rot. Bonds3

About 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine

2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine (PubChem CID 110326724) has the molecular formula C17H18FNO3S and a molecular weight of 335.40 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine.

Molecular Properties

Compound Name2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine
PubChem CID110326724
Molecular FormulaC17H18FNO3S
Molecular Weight335.40 g/mol
Exact Mass335.10
IUPAC Name2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine
SMILESCc1cccc(S(=O)(=O)N2CCOC(c3ccccc3F)C2)c1
InChIInChI=1S/C17H18FNO3S/c1-13-5-4-6-14(11-13)23(20,21)19-9-10-22-17(12-19)15-7-2-3-8-16(15)18/h2-8,11,17H,9-10,12H2,1H3
InChIKeyRLDXLNAFCKFFPN-UHFFFAOYSA-N
XLogP2.90
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-(2-fluorophenyl)morpholin-4-yl]sulfonyl-1,3-dihydroindol-2-one
CID 110326740
2-(2-chlorophenyl)-4-(3-chlorophenyl)sulfonylmorpholine
CID 110326938
[(2R)-4-(3-methylphenyl)sulfonylmorpholin-2-yl]methanamine
CID 42252952
4-butylsulfonyl-2-(2-fluorophenyl)morpholine
CID 110326692
4-(3-fluorophenyl)sulfonyl-2-(5-methyl-1H-imidazol-2-yl)morpholine
CID 110105191
(2S)-4-(3-chlorophenyl)sulfonyl-2-phenylmorpholine
CID 51696505
2-(2-fluorophenyl)-4-[2-(3-methoxyphenyl)ethylsulfonyl]morpholine
CID 110609355
2-(2-chlorophenyl)-4-(3,4-dimethoxyphenyl)sulfonylmorpholine
CID 110326908
methyl 2-[4-(3-methylphenyl)sulfonylmorpholin-2-yl]acetate
CID 79764305
3-[2-(4-chlorophenyl)morpholin-4-yl]sulfonylbenzoic acid
CID 110416888
2-(4-methylphenyl)-4-(4-methylphenyl)sulfonylmorpholine
CID 110326567
2-(2-chlorophenyl)-4-(4-methoxyphenyl)sulfonylmorpholine
CID 110326898

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine?
The IUPAC name of 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine (CID 110326724) is 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine.
What is the SMILES notation for 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine?
The canonical SMILES for 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine is Cc1cccc(S(=O)(=O)N2CCOC(c3ccccc3F)C2)c1.
What is the InChIKey of 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine?
The InChIKey is RLDXLNAFCKFFPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO3S/c1-13-5-4-6-14(11-13)23(20,21)19-9-10-22-17(12-19)15-7-2-3-8-16(15)18/h2-8,11,17H,9-10,12H2,1H3.
What are the key properties of 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine?
2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine has a molecular weight of 335.40 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-4-(3-methylphenyl)sulfonylmorpholine is sourced from PubChem (CID 110326724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).