2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole

C10H15NO — CID 143984574

IUPAC2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole
SMILESCC/C(C)=C\c1nc(C)oc1C
InChIInChI=1S/C10H15NO/c1-5-7(2)6-10-8(3)12-9(4)11-10/h6H,5H2,1-4H3/b7-6-
InChIKeyIWGYBCLRIWXHFY-SREVYHEPSA-N
MW165.24 g/mol
LogP3.10
Rot. Bonds2

About 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole

2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole (PubChem CID 143984574) has the molecular formula C10H15NO and a molecular weight of 165.24 g/mol. Its IUPAC name is 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole.

Molecular Properties

Compound Name2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole
PubChem CID143984574
Molecular FormulaC10H15NO
Molecular Weight165.24 g/mol
Exact Mass165.12
IUPAC Name2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole
SMILESCC/C(C)=C\c1nc(C)oc1C
InChIInChI=1S/C10H15NO/c1-5-7(2)6-10-8(3)12-9(4)11-10/h6H,5H2,1-4H3/b7-6-
InChIKeyIWGYBCLRIWXHFY-SREVYHEPSA-N
XLogP3.10
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dimethyl-4-[(Z)-3-methylidenepent-1-enyl]-1,3-oxazole
CID 143346683
ethane;4-ethenyl-2,5-dimethyl-1,3-oxazole
CID 143838762
ethane;5-ethyl-2-methyl-4-[(Z)-prop-1-enyl]-1,3-oxazole
CID 143277087
2-methyl-4-(2-methylbut-1-enyl)-1,3-thiazole
CID 74067620
2-methyl-6-[(E)-2-methylbut-1-enyl]pyridine
CID 130317749
(Z)-3-methylpent-2-ene;(E)-3-methylpent-2-ene
CID 44630372
ethane;(E)-3-methylpent-2-ene
CID 144523626
3-methylpent-2-ene;zirconium
CID 174393280
ethane;4-ethenyl-2-methyl-5-prop-1-en-2-yl-1,3-oxazole
CID 172571272
ethane;3-methylpent-2-ene;propane
CID 144514263
1-methyl-2-(2-methylbut-1-enyl)benzene
CID 123992258
sodium;hydride;5-hydroxy-2-methyl-1,3-oxazole-4-carbaldehyde
CID 173118852

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole?
The IUPAC name of 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole (CID 143984574) is 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole.
What is the SMILES notation for 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole?
The canonical SMILES for 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole is CC/C(C)=C\c1nc(C)oc1C.
What is the InChIKey of 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole?
The InChIKey is IWGYBCLRIWXHFY-SREVYHEPSA-N. The full InChI is InChI=1S/C10H15NO/c1-5-7(2)6-10-8(3)12-9(4)11-10/h6H,5H2,1-4H3/b7-6-.
What are the key properties of 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole?
2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole has a molecular weight of 165.24 g/mol, XLogP of 3.10, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-4-[(Z)-2-methylbut-1-enyl]-1,3-oxazole is sourced from PubChem (CID 143984574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).