methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole

C14H26N2O2 — CID 158221821

IUPACmethane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole
SMILESC.C.CC(C)c1ccno1.CC(C)c1cnco1
InChIInChI=1S/2C6H9NO.2CH4/c1-5(2)6-3-7-4-8-6;1-5(2)6-3-4-7-8-6;;/h2*3-5H,1-2H3;2*1H4
InChIKeyGDIHWPGJKQLDMU-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.87
Rot. Bonds2

About methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole

methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole (PubChem CID 158221821) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole.

Molecular Properties

Compound Namemethane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole
PubChem CID158221821
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC Namemethane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole
SMILESC.C.CC(C)c1ccno1.CC(C)c1cnco1
InChIInChI=1S/2C6H9NO.2CH4/c1-5(2)6-3-7-4-8-6;1-5(2)6-3-4-7-8-6;;/h2*3-5H,1-2H3;2*1H4
InChIKeyGDIHWPGJKQLDMU-UHFFFAOYSA-N
XLogP4.87
TPSA52.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole?
The IUPAC name of methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole (CID 158221821) is methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole.
What is the SMILES notation for methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole?
The canonical SMILES for methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole is C.C.CC(C)c1ccno1.CC(C)c1cnco1.
What is the InChIKey of methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole?
The InChIKey is GDIHWPGJKQLDMU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H9NO.2CH4/c1-5(2)6-3-7-4-8-6;1-5(2)6-3-4-7-8-6;;/h2*3-5H,1-2H3;2*1H4.
What are the key properties of methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole?
methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole has a molecular weight of 254.37 g/mol, XLogP of 4.87, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methane;5-propan-2-yl-1,2-oxazole;5-propan-2-yl-1,3-oxazole is sourced from PubChem (CID 158221821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).