7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol

C21H22FN3O2 — CID 87639857

IUPAC7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol
SMILESOc1c(Cc2ccc(F)cc2)nc(CCN2CCOCC2)c2cccnc12
InChIInChI=1S/C21H22FN3O2/c22-16-5-3-15(4-6-16)14-19-21(26)20-17(2-1-8-23-20)18(24-19)7-9-25-10-12-27-13-11-25/h1-6,8,26H,7,9-14H2
InChIKeyOEYRLCHRXQEYBG-UHFFFAOYSA-N
MW367.42 g/mol
LogP2.94
Rot. Bonds5

About 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol

7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol (PubChem CID 87639857) has the molecular formula C21H22FN3O2 and a molecular weight of 367.42 g/mol. Its IUPAC name is 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol.

Molecular Properties

Compound Name7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol
PubChem CID87639857
Molecular FormulaC21H22FN3O2
Molecular Weight367.42 g/mol
Exact Mass367.17
IUPAC Name7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol
SMILESOc1c(Cc2ccc(F)cc2)nc(CCN2CCOCC2)c2cccnc12
InChIInChI=1S/C21H22FN3O2/c22-16-5-3-15(4-6-16)14-19-21(26)20-17(2-1-8-23-20)18(24-19)7-9-25-10-12-27-13-11-25/h1-6,8,26H,7,9-14H2
InChIKeyOEYRLCHRXQEYBG-UHFFFAOYSA-N
XLogP2.94
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.42
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol?
The IUPAC name of 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol (CID 87639857) is 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol.
What is the SMILES notation for 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol?
The canonical SMILES for 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol is Oc1c(Cc2ccc(F)cc2)nc(CCN2CCOCC2)c2cccnc12.
What is the InChIKey of 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol?
The InChIKey is OEYRLCHRXQEYBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22FN3O2/c22-16-5-3-15(4-6-16)14-19-21(26)20-17(2-1-8-23-20)18(24-19)7-9-25-10-12-27-13-11-25/h1-6,8,26H,7,9-14H2.
What are the key properties of 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol?
7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol has a molecular weight of 367.42 g/mol, XLogP of 2.94, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(4-fluorophenyl)methyl]-5-(2-morpholin-4-ylethyl)-1,6-naphthyridin-8-ol is sourced from PubChem (CID 87639857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).