2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole

C11H11NO2 — CID 143124580

IUPAC2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole
SMILESC=C1CN=C(c2ccc(OC)cc2)O1
InChIInChI=1S/C11H11NO2/c1-8-7-12-11(14-8)9-3-5-10(13-2)6-4-9/h3-6H,1,7H2,2H3
InChIKeyIPMZRVQCEVXWCI-UHFFFAOYSA-N
MW189.21 g/mol
LogP1.99
Rot. Bonds2

About 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole

2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole (PubChem CID 143124580) has the molecular formula C11H11NO2 and a molecular weight of 189.21 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole
PubChem CID143124580
Molecular FormulaC11H11NO2
Molecular Weight189.21 g/mol
Exact Mass189.08
IUPAC Name2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole
SMILESC=C1CN=C(c2ccc(OC)cc2)O1
InChIInChI=1S/C11H11NO2/c1-8-7-12-11(14-8)9-3-5-10(13-2)6-4-9/h3-6H,1,7H2,2H3
InChIKeyIPMZRVQCEVXWCI-UHFFFAOYSA-N
XLogP1.99
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.21
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(methoxymethoxy)phenyl]-4H-1,3-oxazol-5-one
CID 140703898
5-(fluoromethyl)-2-(4-methoxyphenyl)-4,5-dihydro-1,3-oxazole
CID 138964471
2-(4-methoxyphenyl)-5-[(4-methoxyphenyl)methyl]-4,5-dihydro-1,3-oxazole
CID 132564223
1-methoxy-4-[2-(4-methoxyphenyl)cyclopropen-1-yl]benzene
CID 86037545
2,4,6-tris[4-(4-methoxyphenyl)phenyl]-1,3,5-triazine
CID 20652062
2-(4-methylphenyl)-4H-1,3-oxazol-5-one
CID 10464810
2-(4-methoxyphenyl)-4-propan-2-ylidene-1,3-oxazol-5-one
CID 6488949
4-(4-methoxyphenyl)-1-methylpyrazole
CID 4101323
2-iodo-4-(4-methoxyphenyl)-1,3-oxazole
CID 45139286
3-(4-methoxyphenyl)-5-phenyl-1,4,2-dioxazole
CID 590944
(2R,3R)-2,3-bis(4-methoxyphenyl)-5-methylidene-1,4-dioxane
CID 11716583
1-(113C)methoxy-4-methylbenzene
CID 166176950

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole?
The IUPAC name of 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole (CID 143124580) is 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole?
The canonical SMILES for 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole is C=C1CN=C(c2ccc(OC)cc2)O1.
What is the InChIKey of 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole?
The InChIKey is IPMZRVQCEVXWCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO2/c1-8-7-12-11(14-8)9-3-5-10(13-2)6-4-9/h3-6H,1,7H2,2H3.
What are the key properties of 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole?
2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole has a molecular weight of 189.21 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-methylidene-4H-1,3-oxazole is sourced from PubChem (CID 143124580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).