2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole

C15H21N3O2S — CID 158075783

IUPAC2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole
SMILESCc1cc(C)on1.Cc1cnc(C)o1.Cc1cnc(C)s1
InChIInChI=1S/2C5H7NO.C5H7NS/c1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4/h3*3H,1-2H3
InChIKeyFMIVYSOQBUCKHH-UHFFFAOYSA-N
MW307.42 g/mol
LogP4.34
Rot. Bonds

About 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole

2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole (PubChem CID 158075783) has the molecular formula C15H21N3O2S and a molecular weight of 307.42 g/mol. Its IUPAC name is 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole.

Molecular Properties

Compound Name2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole
PubChem CID158075783
Molecular FormulaC15H21N3O2S
Molecular Weight307.42 g/mol
Exact Mass307.14
IUPAC Name2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole
SMILESCc1cc(C)on1.Cc1cnc(C)o1.Cc1cnc(C)s1
InChIInChI=1S/2C5H7NO.C5H7NS/c1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4/h3*3H,1-2H3
InChIKeyFMIVYSOQBUCKHH-UHFFFAOYSA-N
XLogP4.34
TPSA64.95 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.42
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole with MolForge

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Related Compounds

Bis(3,5-dimethyl-1,2-oxazole);2,5-dimethyl-1,3-thiazole
CID 143923976
2,5-Dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole
CID 144982112
3-Methyl-5-[[2-(1,3-oxazol-5-ylmethyl)-1,3-thiazol-4-yl]methyl]-1,2-oxazole
CID 156554927
2,5-Di(propan-2-yl)-1,3-oxazole;3,5-di(propan-2-yl)-1,2-oxazole;bis(2,5-di(propan-2-yl)-1,3-thiazole);methane
CID 159178983
2,5-Dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyltetrazole;2,5-dimethyl-1,3-thiazole
CID 159355043
2-(2,2-Dimethylpropyl)-5-methyl-1,3-oxazole;3-(2,2-dimethylpropyl)-5-methyl-1,2-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-thiazole
CID 160006332
Bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);3,5-dimethyl-1,2-oxazole;bis(2,4-dimethyl-1,3-thiazole);bis(2,5-dimethyl-1,3-thiazole);bis(3,5-dimethyl-1,2-thiazole)
CID 160696716
Bis(2,4-dimethyl-1,3-oxazole);bis(2,5-dimethyl-1,3-oxazole);3,5-dimethyl-1,2-oxazole;2,4-dimethyl-1,3-thiazole;bis(2,5-dimethyl-1,3-thiazole);bis(3,5-dimethyl-1,2-thiazole)
CID 161607256
2,5-Di(propan-2-yl)-1,3-oxazole;3,5-di(propan-2-yl)-1,2-oxazole;bis(2,5-di(propan-2-yl)-1,3-thiazole)
CID 161982996
3,5-Dimethyl-4-propan-2-yl-1,2-oxazole;3-methyl-4-propan-2-yl-1,2-oxazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole
CID 163488651
3,5-Dimethyl-4-propan-2-yl-1,2-oxazole;2-propan-2-yl-1,3-oxazole;2-propan-2-yl-1,3-thiazole
CID 164137813
5-(2,2-Dimethylpropyl)-2-methylidene-1,3-oxazolidine;2-(2,2-dimethylpropyl)-5-methyl-1,3-oxazole;5-(2,2-dimethylpropyl)-3-methyl-1,2-oxazole;2-(2,2-dimethylpropyl)-5-methyl-1,3-thiazole
CID 167613932

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole?
The IUPAC name of 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole (CID 158075783) is 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole.
What is the SMILES notation for 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole?
The canonical SMILES for 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole is Cc1cc(C)on1.Cc1cnc(C)o1.Cc1cnc(C)s1.
What is the InChIKey of 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole?
The InChIKey is FMIVYSOQBUCKHH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H7NO.C5H7NS/c1-4-3-6-5(2)7-4;1-4-3-5(2)7-6-4;1-4-3-6-5(2)7-4/h3*3H,1-2H3.
What are the key properties of 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole?
2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole has a molecular weight of 307.42 g/mol, XLogP of 4.34, 0 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1,3-oxazole;3,5-dimethyl-1,2-oxazole;2,5-dimethyl-1,3-thiazole is sourced from PubChem (CID 158075783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).