7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol

C20H19FN2O2 — CID 3509636

IUPAC7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol
SMILESOc1c(C(c2ccc(F)cc2)N2CCOCC2)ccc2cccnc12
InChIInChI=1S/C20H19FN2O2/c21-16-6-3-15(4-7-16)19(23-10-12-25-13-11-23)17-8-5-14-2-1-9-22-18(14)20(17)24/h1-9,19,24H,10-13H2
InChIKeyWUUASRHRNXRJTE-UHFFFAOYSA-N
MW338.38 g/mol
LogP3.50
Rot. Bonds3

About 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol

7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol (PubChem CID 3509636) has the molecular formula C20H19FN2O2 and a molecular weight of 338.38 g/mol. Its IUPAC name is 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol.

Molecular Properties

Compound Name7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol
PubChem CID3509636
Molecular FormulaC20H19FN2O2
Molecular Weight338.38 g/mol
Exact Mass338.14
IUPAC Name7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol
SMILESOc1c(C(c2ccc(F)cc2)N2CCOCC2)ccc2cccnc12
InChIInChI=1S/C20H19FN2O2/c21-16-6-3-15(4-7-16)19(23-10-12-25-13-11-23)17-8-5-14-2-1-9-22-18(14)20(17)24/h1-9,19,24H,10-13H2
InChIKeyWUUASRHRNXRJTE-UHFFFAOYSA-N
XLogP3.50
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.38
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol?
The IUPAC name of 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol (CID 3509636) is 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol.
What is the SMILES notation for 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol?
The canonical SMILES for 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol is Oc1c(C(c2ccc(F)cc2)N2CCOCC2)ccc2cccnc12.
What is the InChIKey of 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol?
The InChIKey is WUUASRHRNXRJTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2O2/c21-16-6-3-15(4-7-16)19(23-10-12-25-13-11-23)17-8-5-14-2-1-9-22-18(14)20(17)24/h1-9,19,24H,10-13H2.
What are the key properties of 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol?
7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol has a molecular weight of 338.38 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(4-fluorophenyl)-morpholin-4-ylmethyl]quinolin-8-ol is sourced from PubChem (CID 3509636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).