5-methyl-4-phenyl-2-propyl-1,3-oxazole

C13H15NO — CID 118043112

IUPAC5-methyl-4-phenyl-2-propyl-1,3-oxazole
SMILESCCCc1nc(-c2ccccc2)c(C)o1
InChIInChI=1S/C13H15NO/c1-3-7-12-14-13(10(2)15-12)11-8-5-4-6-9-11/h4-6,8-9H,3,7H2,1-2H3
InChIKeyCZZAIZACAULMJN-UHFFFAOYSA-N
MW201.27 g/mol
LogP3.60
Rot. Bonds3

About 5-methyl-4-phenyl-2-propyl-1,3-oxazole

5-methyl-4-phenyl-2-propyl-1,3-oxazole (PubChem CID 118043112) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 5-methyl-4-phenyl-2-propyl-1,3-oxazole.

Molecular Properties

Compound Name5-methyl-4-phenyl-2-propyl-1,3-oxazole
PubChem CID118043112
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name5-methyl-4-phenyl-2-propyl-1,3-oxazole
SMILESCCCc1nc(-c2ccccc2)c(C)o1
InChIInChI=1S/C13H15NO/c1-3-7-12-14-13(10(2)15-12)11-8-5-4-6-9-11/h4-6,8-9H,3,7H2,1-2H3
InChIKeyCZZAIZACAULMJN-UHFFFAOYSA-N
XLogP3.60
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 53.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Oxazole, 2-methyl-4,5-diphenyl-
CID 139703
5-Methyl-2-phenyl-4-oxazoleacetic acid
CID 2775139
2-(5-Methyl-2-phenyl-4-oxazolyl)ethanol
CID 725585
5-Methyl-4-phenyl-1,3-oxazole-2-carboxamide
CID 2739606
(Z)-1-(4-phenyloxazol-2-yl)octadec-9-en-1-one
CID 10070106
7-Phenyl-1-(4-phenyloxazol-2-yl)heptan-1-one
CID 44554614
Benzilam
CID 275930
4-Methyl-2-phenyloxazole-5-carboxamide
CID 72763
Methyl (5-methyl-2-phenyl-1,3-oxazol-4-yl)acetate
CID 2775318
4-(Chloromethyl)-5-methyl-2-phenyl-1,3-oxazole
CID 9794289
Oxazole, 2-methyl-4-phenyl-
CID 88639
2,4-Diphenyl-5-methyloxazole
CID 4296141

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-phenyl-2-propyl-1,3-oxazole?
The IUPAC name of 5-methyl-4-phenyl-2-propyl-1,3-oxazole (CID 118043112) is 5-methyl-4-phenyl-2-propyl-1,3-oxazole.
What is the SMILES notation for 5-methyl-4-phenyl-2-propyl-1,3-oxazole?
The canonical SMILES for 5-methyl-4-phenyl-2-propyl-1,3-oxazole is CCCc1nc(-c2ccccc2)c(C)o1.
What is the InChIKey of 5-methyl-4-phenyl-2-propyl-1,3-oxazole?
The InChIKey is CZZAIZACAULMJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-3-7-12-14-13(10(2)15-12)11-8-5-4-6-9-11/h4-6,8-9H,3,7H2,1-2H3.
What are the key properties of 5-methyl-4-phenyl-2-propyl-1,3-oxazole?
5-methyl-4-phenyl-2-propyl-1,3-oxazole has a molecular weight of 201.27 g/mol, XLogP of 3.60, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-phenyl-2-propyl-1,3-oxazole is sourced from PubChem (CID 118043112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).