5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride

C7H16F7NO — CID 160956743

IUPAC5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride
SMILESCC.CC1(C)CN=CO1.F.FF.FF.FF
InChIInChI=1S/C5H9NO.C2H6.3F2.FH/c1-5(2)3-6-4-7-5;4*1-2;/h4H,3H2,1-2H3;1-2H3;;;;1H
InChIKeySWMHWBZQMDNSAD-UHFFFAOYSA-N
MW263.20 g/mol
LogP4.52
Rot. Bonds

About 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride

5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride (PubChem CID 160956743) has the molecular formula C7H16F7NO and a molecular weight of 263.20 g/mol. Its IUPAC name is 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride.

Molecular Properties

Compound Name5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride
PubChem CID160956743
Molecular FormulaC7H16F7NO
Molecular Weight263.20 g/mol
Exact Mass263.11
IUPAC Name5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride
SMILESCC.CC1(C)CN=CO1.F.FF.FF.FF
InChIInChI=1S/C5H9NO.C2H6.3F2.FH/c1-5(2)3-6-4-7-5;4*1-2;/h4H,3H2,1-2H3;1-2H3;;;;1H
InChIKeySWMHWBZQMDNSAD-UHFFFAOYSA-N
XLogP4.52
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.20
LogP ≤ 54.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride 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 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride?
The IUPAC name of 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride (CID 160956743) is 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride.
What is the SMILES notation for 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride?
The canonical SMILES for 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride is CC.CC1(C)CN=CO1.F.FF.FF.FF.
What is the InChIKey of 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride?
The InChIKey is SWMHWBZQMDNSAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO.C2H6.3F2.FH/c1-5(2)3-6-4-7-5;4*1-2;/h4H,3H2,1-2H3;1-2H3;;;;1H.
What are the key properties of 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride?
5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride has a molecular weight of 263.20 g/mol, XLogP of 4.52, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-4H-1,3-oxazole;ethane;molecular fluorine;hydrofluoride is sourced from PubChem (CID 160956743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).