1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone

C19H15N3O2 — CID 57392394

IUPAC1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone
SMILESCC(=O)N1N=C(c2ccc3ccccc3c2)OC1c1ccccn1
InChIInChI=1S/C19H15N3O2/c1-13(23)22-19(17-8-4-5-11-20-17)24-18(21-22)16-10-9-14-6-2-3-7-15(14)12-16/h2-12,19H,1H3
InChIKeyCXQNEVRYYVNEPN-UHFFFAOYSA-N
MW317.35 g/mol
LogP3.47
Rot. Bonds2

About 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone

1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone (PubChem CID 57392394) has the molecular formula C19H15N3O2 and a molecular weight of 317.35 g/mol. Its IUPAC name is 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone.

Molecular Properties

Compound Name1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone
PubChem CID57392394
Molecular FormulaC19H15N3O2
Molecular Weight317.35 g/mol
Exact Mass317.12
IUPAC Name1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone
SMILESCC(=O)N1N=C(c2ccc3ccccc3c2)OC1c1ccccn1
InChIInChI=1S/C19H15N3O2/c1-13(23)22-19(17-8-4-5-11-20-17)24-18(21-22)16-10-9-14-6-2-3-7-15(14)12-16/h2-12,19H,1H3
InChIKeyCXQNEVRYYVNEPN-UHFFFAOYSA-N
XLogP3.47
TPSA54.79 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.35
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone?
The IUPAC name of 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone (CID 57392394) is 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone.
What is the SMILES notation for 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone?
The canonical SMILES for 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone is CC(=O)N1N=C(c2ccc3ccccc3c2)OC1c1ccccn1.
What is the InChIKey of 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone?
The InChIKey is CXQNEVRYYVNEPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N3O2/c1-13(23)22-19(17-8-4-5-11-20-17)24-18(21-22)16-10-9-14-6-2-3-7-15(14)12-16/h2-12,19H,1H3.
What are the key properties of 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone?
1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone has a molecular weight of 317.35 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-naphthalen-2-yl-2-pyridin-2-yl-2H-1,3,4-oxadiazol-3-yl)ethanone is sourced from PubChem (CID 57392394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).