7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol

C17H12N4O2 — CID 135519339

IUPAC7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol
SMILESOc1c(-c2noc(Cc3ccccc3)n2)ncc2cccnc12
InChIInChI=1S/C17H12N4O2/c22-16-14-12(7-4-8-18-14)10-19-15(16)17-20-13(23-21-17)9-11-5-2-1-3-6-11/h1-8,10,22H,9H2
InChIKeyKZOPRHDWMBCDFC-UHFFFAOYSA-N
MW304.31 g/mol
LogP2.98
Rot. Bonds3

About 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol

7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol (PubChem CID 135519339) has the molecular formula C17H12N4O2 and a molecular weight of 304.31 g/mol. Its IUPAC name is 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol.

Molecular Properties

Compound Name7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol
PubChem CID135519339
Molecular FormulaC17H12N4O2
Molecular Weight304.31 g/mol
Exact Mass304.10
IUPAC Name7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol
SMILESOc1c(-c2noc(Cc3ccccc3)n2)ncc2cccnc12
InChIInChI=1S/C17H12N4O2/c22-16-14-12(7-4-8-18-14)10-19-15(16)17-20-13(23-21-17)9-11-5-2-1-3-6-11/h1-8,10,22H,9H2
InChIKeyKZOPRHDWMBCDFC-UHFFFAOYSA-N
XLogP2.98
TPSA84.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.31
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol?
The IUPAC name of 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol (CID 135519339) is 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol.
What is the SMILES notation for 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol?
The canonical SMILES for 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol is Oc1c(-c2noc(Cc3ccccc3)n2)ncc2cccnc12.
What is the InChIKey of 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol?
The InChIKey is KZOPRHDWMBCDFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N4O2/c22-16-14-12(7-4-8-18-14)10-19-15(16)17-20-13(23-21-17)9-11-5-2-1-3-6-11/h1-8,10,22H,9H2.
What are the key properties of 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol?
7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol has a molecular weight of 304.31 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5-benzyl-1,2,4-oxadiazol-3-yl)-1,6-naphthyridin-8-ol is sourced from PubChem (CID 135519339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).