5-naphthalen-2-yl-2-phenyl-1,3-oxazole

C19H13NO — CID 11277264

IUPAC5-naphthalen-2-yl-2-phenyl-1,3-oxazole
SMILESc1ccc(-c2ncc(-c3ccc4ccccc4c3)o2)cc1
InChIInChI=1S/C19H13NO/c1-2-7-15(8-3-1)19-20-13-18(21-19)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H
InChIKeyZKKGQJXRHITOEU-UHFFFAOYSA-N
MW271.32 g/mol
LogP5.16
Rot. Bonds2

About 5-naphthalen-2-yl-2-phenyl-1,3-oxazole

5-naphthalen-2-yl-2-phenyl-1,3-oxazole (PubChem CID 11277264) has the molecular formula C19H13NO and a molecular weight of 271.32 g/mol. Its IUPAC name is 5-naphthalen-2-yl-2-phenyl-1,3-oxazole.

Molecular Properties

Compound Name5-naphthalen-2-yl-2-phenyl-1,3-oxazole
PubChem CID11277264
Molecular FormulaC19H13NO
Molecular Weight271.32 g/mol
Exact Mass271.10
IUPAC Name5-naphthalen-2-yl-2-phenyl-1,3-oxazole
SMILESc1ccc(-c2ncc(-c3ccc4ccccc4c3)o2)cc1
InChIInChI=1S/C19H13NO/c1-2-7-15(8-3-1)19-20-13-18(21-19)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H
InChIKeyZKKGQJXRHITOEU-UHFFFAOYSA-N
XLogP5.16
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500271.32
LogP ≤ 55.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-2-yl-2-phenyl-1,3-oxazole?
The IUPAC name of 5-naphthalen-2-yl-2-phenyl-1,3-oxazole (CID 11277264) is 5-naphthalen-2-yl-2-phenyl-1,3-oxazole.
What is the SMILES notation for 5-naphthalen-2-yl-2-phenyl-1,3-oxazole?
The canonical SMILES for 5-naphthalen-2-yl-2-phenyl-1,3-oxazole is c1ccc(-c2ncc(-c3ccc4ccccc4c3)o2)cc1.
What is the InChIKey of 5-naphthalen-2-yl-2-phenyl-1,3-oxazole?
The InChIKey is ZKKGQJXRHITOEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13NO/c1-2-7-15(8-3-1)19-20-13-18(21-19)17-11-10-14-6-4-5-9-16(14)12-17/h1-13H.
What are the key properties of 5-naphthalen-2-yl-2-phenyl-1,3-oxazole?
5-naphthalen-2-yl-2-phenyl-1,3-oxazole has a molecular weight of 271.32 g/mol, XLogP of 5.16, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-2-yl-2-phenyl-1,3-oxazole is sourced from PubChem (CID 11277264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).