2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole

C18H17NO2 — CID 102463226

IUPAC2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole
SMILESCOc1ccc(-c2ncc(Cc3cccc(C)c3)o2)cc1
InChIInChI=1S/C18H17NO2/c1-13-4-3-5-14(10-13)11-17-12-19-18(21-17)15-6-8-16(20-2)9-7-15/h3-10,12H,11H2,1-2H3
InChIKeyXMANVZBYPONGSH-UHFFFAOYSA-N
MW279.34 g/mol
LogP4.25
Rot. Bonds4

About 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole

2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole (PubChem CID 102463226) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole
PubChem CID102463226
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole
SMILESCOc1ccc(-c2ncc(Cc3cccc(C)c3)o2)cc1
InChIInChI=1S/C18H17NO2/c1-13-4-3-5-14(10-13)11-17-12-19-18(21-17)15-6-8-16(20-2)9-7-15/h3-10,12H,11H2,1-2H3
InChIKeyXMANVZBYPONGSH-UHFFFAOYSA-N
XLogP4.25
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-Diphenyloxazole
CID 7105
3-(5-(4-Methoxyphenyl)-2-oxazolyl)pyridine
CID 928446
2,5-Bis(4-biphenylyl)oxazole
CID 95231
Pyridine, 3-[5-[4-[(3-methyl-2-butenyl)oxy]phenyl]-2-oxazolyl]-
CID 617263
UA62784
CID 3383533
2-(Biphenyl-4-yl)-5-phenyloxazole
CID 96728
1-Oxo-1-[5-(2-pyridyl)oxazol-2-yl]-7-(4-methoxyphenyl)heptane
CID 16735383
3-[5-(4-Hydroxyphenyl)-1,3-oxazol-2-yl]phenol
CID 24857878
3-Methyl-2,5-diphenyl-1,3-oxazol-3-ium
CID 2313868
2-(3-Methoxyphenyl)-5-phenyloxazole
CID 520919
N-hydroxy-7-[5-(4-methoxyphenyl)-1,3-oxazol-2-yl]heptanamide
CID 10426019
(R)-2-(2-(4-(oxazol-5-yl)phenoxy)ethylamino)-1-(pyridin-3-yl)ethanol
CID 9858464

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole?
The IUPAC name of 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole (CID 102463226) is 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole?
The canonical SMILES for 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole is COc1ccc(-c2ncc(Cc3cccc(C)c3)o2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole?
The InChIKey is XMANVZBYPONGSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-13-4-3-5-14(10-13)11-17-12-19-18(21-17)15-6-8-16(20-2)9-7-15/h3-10,12H,11H2,1-2H3.
What are the key properties of 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole?
2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole has a molecular weight of 279.34 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-[(3-methylphenyl)methyl]-1,3-oxazole is sourced from PubChem (CID 102463226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).