(2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine

C20H19FN2O3S — CID 25348522

IUPAC(2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine
SMILESCc1cnc2c(S(=O)(=O)N3CCO[C@H](c4ccc(F)cc4)C3)cccc2c1
InChIInChI=1S/C20H19FN2O3S/c1-14-11-16-3-2-4-19(20(16)22-12-14)27(24,25)23-9-10-26-18(13-23)15-5-7-17(21)8-6-15/h2-8,11-12,18H,9-10,13H2,1H3/t18-/m0/s1
InChIKeyMGZUGHUCQGMRJL-SFHVURJKSA-N
MW386.45 g/mol
LogP3.44
Rot. Bonds3

About (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine

(2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine (PubChem CID 25348522) has the molecular formula C20H19FN2O3S and a molecular weight of 386.45 g/mol. Its IUPAC name is (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine.

Molecular Properties

Compound Name(2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine
PubChem CID25348522
Molecular FormulaC20H19FN2O3S
Molecular Weight386.45 g/mol
Exact Mass386.11
IUPAC Name(2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine
SMILESCc1cnc2c(S(=O)(=O)N3CCO[C@H](c4ccc(F)cc4)C3)cccc2c1
InChIInChI=1S/C20H19FN2O3S/c1-14-11-16-3-2-4-19(20(16)22-12-14)27(24,25)23-9-10-26-18(13-23)15-5-7-17(21)8-6-15/h2-8,11-12,18H,9-10,13H2,1H3/t18-/m0/s1
InChIKeyMGZUGHUCQGMRJL-SFHVURJKSA-N
XLogP3.44
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.45
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine?
The IUPAC name of (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine (CID 25348522) is (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine.
What is the SMILES notation for (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine?
The canonical SMILES for (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine is Cc1cnc2c(S(=O)(=O)N3CCO[C@H](c4ccc(F)cc4)C3)cccc2c1.
What is the InChIKey of (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine?
The InChIKey is MGZUGHUCQGMRJL-SFHVURJKSA-N. The full InChI is InChI=1S/C20H19FN2O3S/c1-14-11-16-3-2-4-19(20(16)22-12-14)27(24,25)23-9-10-26-18(13-23)15-5-7-17(21)8-6-15/h2-8,11-12,18H,9-10,13H2,1H3/t18-/m0/s1.
What are the key properties of (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine?
(2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine has a molecular weight of 386.45 g/mol, XLogP of 3.44, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(4-fluorophenyl)-4-(3-methylquinolin-8-yl)sulfonylmorpholine is sourced from PubChem (CID 25348522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).