2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole

C10H16FN3O — CID 169162899

IUPAC2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole
SMILESCC(C)c1nnc(N2CCC(F)CC2)o1
InChIInChI=1S/C10H16FN3O/c1-7(2)9-12-13-10(15-9)14-5-3-8(11)4-6-14/h7-8H,3-6H2,1-2H3
InChIKeyMRINAGVTAHBECI-UHFFFAOYSA-N
MW213.26 g/mol
LogP2.13
Rot. Bonds2

About 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole

2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole (PubChem CID 169162899) has the molecular formula C10H16FN3O and a molecular weight of 213.26 g/mol. Its IUPAC name is 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole
PubChem CID169162899
Molecular FormulaC10H16FN3O
Molecular Weight213.26 g/mol
Exact Mass213.13
IUPAC Name2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole
SMILESCC(C)c1nnc(N2CCC(F)CC2)o1
InChIInChI=1S/C10H16FN3O/c1-7(2)9-12-13-10(15-9)14-5-3-8(11)4-6-14/h7-8H,3-6H2,1-2H3
InChIKeyMRINAGVTAHBECI-UHFFFAOYSA-N
XLogP2.13
TPSA42.16 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.26
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole 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 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole?
The IUPAC name of 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole (CID 169162899) is 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole?
The canonical SMILES for 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole is CC(C)c1nnc(N2CCC(F)CC2)o1.
What is the InChIKey of 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole?
The InChIKey is MRINAGVTAHBECI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16FN3O/c1-7(2)9-12-13-10(15-9)14-5-3-8(11)4-6-14/h7-8H,3-6H2,1-2H3.
What are the key properties of 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole?
2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole has a molecular weight of 213.26 g/mol, XLogP of 2.13, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoropiperidin-1-yl)-5-propan-2-yl-1,3,4-oxadiazole is sourced from PubChem (CID 169162899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).