5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole

C14H12N2O2 — CID 139721162

IUPAC5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole
SMILESC=C1CN=C(c2cccc(C3=NCC(=C)O3)c2)O1
InChIInChI=1S/C14H12N2O2/c1-9-7-15-13(17-9)11-4-3-5-12(6-11)14-16-8-10(2)18-14/h3-6H,1-2,7-8H2
InChIKeyVYHUWGLOKXQJNR-UHFFFAOYSA-N
MW240.26 g/mol
LogP2.27
Rot. Bonds2

About 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole

5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole (PubChem CID 139721162) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole.

Molecular Properties

Compound Name5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole
PubChem CID139721162
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Name5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole
SMILESC=C1CN=C(c2cccc(C3=NCC(=C)O3)c2)O1
InChIInChI=1S/C14H12N2O2/c1-9-7-15-13(17-9)11-4-3-5-12(6-11)14-16-8-10(2)18-14/h3-6H,1-2,7-8H2
InChIKeyVYHUWGLOKXQJNR-UHFFFAOYSA-N
XLogP2.27
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-methylidene-2-[4-(trifluoromethyl)phenyl]-4H-1,3-oxazole
CID 62707306
2-phenyl-4H-1,3-oxazole-5-thione
CID 163499090
(5E)-5-[iodo(phenyl)methylidene]-2-phenyl-4H-1,3-oxazole
CID 54769671
2-[3-[4,6-bis[3-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]-1,3,5-triazin-2-yl]phenyl]-4,5-dihydro-1,3-oxazole
CID 135250784
2-[3-[17-[3-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]-8,14-dioxa-1-borapentacyclo[11.7.1.02,7.09,21.015,20]henicosa-2(7),3,5,9(21),10,12,15(20),16,18-nonaen-5-yl]phenyl]-4,5-dihydro-1,3-oxazole
CID 140889239
bicyclo[3.1.0]hexa-1(6),2,4-triene;hydroiodide
CID 174338176
3-(4,5-dihydro-1,3-oxazol-2-yl)phenol
CID 139059691
N,N-dimethyl-3-(4-methylidene-5-oxo-1,3-oxazol-2-yl)benzenesulfonamide
CID 167119396
trimethyl-[3-[4-[3-[4-(3-trimethylsilylphenyl)phenyl]phenyl]phenyl]phenyl]silane
CID 101404035
1-[3-(4,5-dihydro-1,3-oxazol-2-yl)phenyl]ethanamine
CID 84662651
2-(4-methylphenyl)-4H-1,3-oxazol-5-one
CID 10464810
5-phenyl-3-[3-(5-phenyl-4,5-dihydro-1,2-oxazol-3-yl)phenyl]-4,5-dihydro-1,2-oxazole
CID 139240735

Frequently Asked Questions

What is the IUPAC name of 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole?
The IUPAC name of 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole (CID 139721162) is 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole.
What is the SMILES notation for 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole?
The canonical SMILES for 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole is C=C1CN=C(c2cccc(C3=NCC(=C)O3)c2)O1.
What is the InChIKey of 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole?
The InChIKey is VYHUWGLOKXQJNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O2/c1-9-7-15-13(17-9)11-4-3-5-12(6-11)14-16-8-10(2)18-14/h3-6H,1-2,7-8H2.
What are the key properties of 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole?
5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole has a molecular weight of 240.26 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylidene-2-[3-(5-methylidene-4H-1,3-oxazol-2-yl)phenyl]-4H-1,3-oxazole is sourced from PubChem (CID 139721162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).