5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole

C19H15NO — CID 10265312

IUPAC5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole
SMILESc1ccc(C2=NOC(c3cccc4ccccc34)C2)cc1
InChIInChI=1S/C19H15NO/c1-2-8-15(9-3-1)18-13-19(21-20-18)17-12-6-10-14-7-4-5-11-16(14)17/h1-12,19H,13H2
InChIKeyNXHJLVDBAMVVOG-UHFFFAOYSA-N
MW273.34 g/mol
LogP4.71
Rot. Bonds2

About 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole

5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole (PubChem CID 10265312) has the molecular formula C19H15NO and a molecular weight of 273.34 g/mol. Its IUPAC name is 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole.

Molecular Properties

Compound Name5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole
PubChem CID10265312
Molecular FormulaC19H15NO
Molecular Weight273.34 g/mol
Exact Mass273.12
IUPAC Name5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole
SMILESc1ccc(C2=NOC(c3cccc4ccccc34)C2)cc1
InChIInChI=1S/C19H15NO/c1-2-8-15(9-3-1)18-13-19(21-20-18)17-12-6-10-14-7-4-5-11-16(14)17/h1-12,19H,13H2
InChIKeyNXHJLVDBAMVVOG-UHFFFAOYSA-N
XLogP4.71
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole?
The IUPAC name of 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole (CID 10265312) is 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole.
What is the SMILES notation for 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole?
The canonical SMILES for 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole is c1ccc(C2=NOC(c3cccc4ccccc34)C2)cc1.
What is the InChIKey of 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole?
The InChIKey is NXHJLVDBAMVVOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO/c1-2-8-15(9-3-1)18-13-19(21-20-18)17-12-6-10-14-7-4-5-11-16(14)17/h1-12,19H,13H2.
What are the key properties of 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole?
5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole has a molecular weight of 273.34 g/mol, XLogP of 4.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-naphthalen-1-yl-3-phenyl-4,5-dihydro-1,2-oxazole is sourced from PubChem (CID 10265312), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).