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

C20H15NO — CID 42611623

IUPAC5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole
SMILESCc1oc(-c2ccccc2)nc1-c1cccc2ccccc12
InChIInChI=1S/C20H15NO/c1-14-19(21-20(22-14)16-9-3-2-4-10-16)18-13-7-11-15-8-5-6-12-17(15)18/h2-13H,1H3
InChIKeyHRPCFPZSTKCEIN-UHFFFAOYSA-N
MW285.35 g/mol
LogP5.47
Rot. Bonds2

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

5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole (PubChem CID 42611623) has the molecular formula C20H15NO and a molecular weight of 285.35 g/mol. Its IUPAC name is 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole.

Molecular Properties

Compound Name5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole
PubChem CID42611623
Molecular FormulaC20H15NO
Molecular Weight285.35 g/mol
Exact Mass285.12
IUPAC Name5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole
SMILESCc1oc(-c2ccccc2)nc1-c1cccc2ccccc12
InChIInChI=1S/C20H15NO/c1-14-19(21-20(22-14)16-9-3-2-4-10-16)18-13-7-11-15-8-5-6-12-17(15)18/h2-13H,1H3
InChIKeyHRPCFPZSTKCEIN-UHFFFAOYSA-N
XLogP5.47
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.35
LogP ≤ 55.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-naphthalen-1-yl-2-phenyl-N-(1-phenylethyl)-1,3-oxazol-5-amine
CID 16759407
N,N-diethyl-4-(4-naphthalen-1-yl-5-phenyl-1,3-oxazol-2-yl)aniline
CID 139802778
4-(1-benzylpyridin-1-ium-4-yl)-5-methyl-2-phenyl-1,3-oxazole
CID 11596633
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methanamine
CID 15616431
3-methyl-2,5-dinaphthalen-1-yl-4-phenylfuran
CID 167273811
2-[4-(3,6-dinaphthalen-1-ylcarbazol-9-yl)phenyl]-5-phenyl-1,3,4-oxadiazole
CID 59445184
5-methyl-2-(4-nitrophenyl)-4-phenyl-1,3-oxazole
CID 57465372
2,3,5-trimethyl-6-(4-naphthalen-1-ylphenyl)pyrazine
CID 58461112
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl naphthalene-1-carboxylate
CID 16588864
N-ethyl-5-methyl-N-naphthalen-1-yl-2-phenyl-1,3-oxazole-4-carboxamide
CID 55614801
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-naphthalen-1-ylacetamide
CID 16614398
2-fluoro-5-(5-methyl-2-phenyl-1,3-oxazol-4-yl)aniline
CID 115049958

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole?
The IUPAC name of 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole (CID 42611623) is 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole.
What is the SMILES notation for 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole?
The canonical SMILES for 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole is Cc1oc(-c2ccccc2)nc1-c1cccc2ccccc12.
What is the InChIKey of 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole?
The InChIKey is HRPCFPZSTKCEIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO/c1-14-19(21-20(22-14)16-9-3-2-4-10-16)18-13-7-11-15-8-5-6-12-17(15)18/h2-13H,1H3.
What are the key properties of 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole?
5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole has a molecular weight of 285.35 g/mol, XLogP of 5.47, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-naphthalen-1-yl-2-phenyl-1,3-oxazole is sourced from PubChem (CID 42611623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).