2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole

C18H15NO — CID 134842548

IUPAC2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole
SMILESCc1nc(-c2ccccc2)c(/C=C/c2ccccc2)[18o]1
InChIInChI=1S/C18H15NO/c1-14-19-18(16-10-6-3-7-11-16)17(20-14)13-12-15-8-4-2-5-9-15/h2-13H,1H3/b13-12+/i20+2
InChIKeyCLKCRCIMUSOHFW-JMTXTOFTSA-N
MW263.32 g/mol
LogP4.82
Rot. Bonds3

About 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole

2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole (PubChem CID 134842548) has the molecular formula C18H15NO and a molecular weight of 263.32 g/mol. Its IUPAC name is 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole.

Molecular Properties

Compound Name2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole
PubChem CID134842548
Molecular FormulaC18H15NO
Molecular Weight263.32 g/mol
Exact Mass263.12
IUPAC Name2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole
SMILESCc1nc(-c2ccccc2)c(/C=C/c2ccccc2)[18o]1
InChIInChI=1S/C18H15NO/c1-14-19-18(16-10-6-3-7-11-16)17(20-14)13-12-15-8-4-2-5-9-15/h2-13H,1H3/b13-12+/i20+2
InChIKeyCLKCRCIMUSOHFW-JMTXTOFTSA-N
XLogP4.82
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.32
LogP ≤ 54.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-methyl-3-phenyl-1-[(E)-2-phenylethenyl]isoquinoline
CID 62707087
2-ethyl-4-phenyl-5-[(E)-2-phenylethenyl]triazole
CID 89104477
4-phenyl-5-(2-phenylethenyl)-2-propan-2-yltriazole
CID 76610001
2,3,5-triphenyl-6-[4-(3,5,6-triphenylpyrazin-2-yl)phenyl]pyrazine
CID 139681938
2,4-diphenyl-5-[(E)-2-phenylethenyl]-1,3-oxazole
CID 14265978
2,6-diphenyl-4-[(E)-2-phenylethenyl]pyridine
CID 164669085
CID 70569152
CID 70569152
CID 70567885
CID 70567885
2-[(E)-2-phenylethenyl]azulene
CID 12674002
N,N-dimethylmethanamine;stilbene
CID 174368184
3,8-dimethyl-6-[3-[(E)-2-phenylethenyl]phenyl]phenanthridine
CID 58281982
methane;1-methyl-4-[(E)-2-phenylethenyl]benzene
CID 144677664

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole?
The IUPAC name of 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole (CID 134842548) is 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole.
What is the SMILES notation for 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole?
The canonical SMILES for 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole is Cc1nc(-c2ccccc2)c(/C=C/c2ccccc2)[18o]1.
What is the InChIKey of 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole?
The InChIKey is CLKCRCIMUSOHFW-JMTXTOFTSA-N. The full InChI is InChI=1S/C18H15NO/c1-14-19-18(16-10-6-3-7-11-16)17(20-14)13-12-15-8-4-2-5-9-15/h2-13H,1H3/b13-12+/i20+2.
What are the key properties of 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole?
2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole has a molecular weight of 263.32 g/mol, XLogP of 4.82, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-phenyl-5-[(E)-2-phenylethenyl]-(118O)1,3-oxazole is sourced from PubChem (CID 134842548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).