2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane

C11H18F2N2O — CID 153404817

IUPAC2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane
SMILESCC.FC(F)c1nnc(C2CCCCC2)o1
InChIInChI=1S/C9H12F2N2O.C2H6/c10-7(11)9-13-12-8(14-9)6-4-2-1-3-5-6;1-2/h6-7H,1-5H2;1-2H3
InChIKeyZJDRANXGFNJUAF-UHFFFAOYSA-N
MW232.27 g/mol
LogP4.08
Rot. Bonds2

About 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane

2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane (PubChem CID 153404817) has the molecular formula C11H18F2N2O and a molecular weight of 232.27 g/mol. Its IUPAC name is 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane.

Molecular Properties

Compound Name2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane
PubChem CID153404817
Molecular FormulaC11H18F2N2O
Molecular Weight232.27 g/mol
Exact Mass232.14
IUPAC Name2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane
SMILESCC.FC(F)c1nnc(C2CCCCC2)o1
InChIInChI=1S/C9H12F2N2O.C2H6/c10-7(11)9-13-12-8(14-9)6-4-2-1-3-5-6;1-2/h6-7H,1-5H2;1-2H3
InChIKeyZJDRANXGFNJUAF-UHFFFAOYSA-N
XLogP4.08
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.27
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane with MolForge

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

Launch Full Analysis

Related Compounds

2-(difluoromethyl)-5-(4-methylcyclohexyl)-1,3,4-oxadiazole
CID 153456384
1-(5-cyclobutyl-1,3,4-oxadiazol-2-yl)ethanamine
CID 62072169
2-(difluoromethyl)-5-(thiolan-2-yl)-1,3,4-oxadiazole
CID 131153737
2-(difluoromethyl)-5-(thiolan-3-yl)-1,3,4-oxadiazole
CID 130678430
2-(1-bromopropyl)-5-cyclopentyl-1,3,4-oxadiazole
CID 62856349
2-cyclobutyl-5-[(1S)-1-methoxyethyl]-1,3,4-oxadiazole
CID 131201326
2-cyclopropyl-5-(1-methylsulfanylethyl)-1,3,4-oxadiazole
CID 126996136
2-cyclohexyl-5-methyl-1,3,4-oxadiazole;methanamine
CID 143346929
2-bromo-5-cyclooctyl-1,3,4-oxadiazole
CID 114771199
2-chloro-5-cyclohexyl-1,3,4-oxadiazole
CID 82281079
2-cyclohexyl-5-methyl-1,3,4-oxadiazole;propane
CID 153404775
1-[5-(4-tert-butylcyclohexyl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 62719072

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane?
The IUPAC name of 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane (CID 153404817) is 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane.
What is the SMILES notation for 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane?
The canonical SMILES for 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane is CC.FC(F)c1nnc(C2CCCCC2)o1.
What is the InChIKey of 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane?
The InChIKey is ZJDRANXGFNJUAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F2N2O.C2H6/c10-7(11)9-13-12-8(14-9)6-4-2-1-3-5-6;1-2/h6-7H,1-5H2;1-2H3.
What are the key properties of 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane?
2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane has a molecular weight of 232.27 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-(difluoromethyl)-1,3,4-oxadiazole;ethane is sourced from PubChem (CID 153404817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).