N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide

C15H23F3N4O2 — CID 128985941

IUPACN-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCC(C)c1nnc(CCC(=O)NC2CCC(C(F)(F)F)N(C)C2)o1
InChIInChI=1S/C15H23F3N4O2/c1-9(2)14-21-20-13(24-14)7-6-12(23)19-10-4-5-11(15(16,17)18)22(3)8-10/h9-11H,4-8H2,1-3H3,(H,19,23)
InChIKeyYURSVFZPTFEMIU-UHFFFAOYSA-N
MW348.37 g/mol
LogP2.27
Rot. Bonds5

About N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide

N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide (PubChem CID 128985941) has the molecular formula C15H23F3N4O2 and a molecular weight of 348.37 g/mol. Its IUPAC name is N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide.

Molecular Properties

Compound NameN-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide
PubChem CID128985941
Molecular FormulaC15H23F3N4O2
Molecular Weight348.37 g/mol
Exact Mass348.18
IUPAC NameN-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide
SMILESCC(C)c1nnc(CCC(=O)NC2CCC(C(F)(F)F)N(C)C2)o1
InChIInChI=1S/C15H23F3N4O2/c1-9(2)14-21-20-13(24-14)7-6-12(23)19-10-4-5-11(15(16,17)18)22(3)8-10/h9-11H,4-8H2,1-3H3,(H,19,23)
InChIKeyYURSVFZPTFEMIU-UHFFFAOYSA-N
XLogP2.27
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.37
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide?
The IUPAC name of N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide (CID 128985941) is N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide.
What is the SMILES notation for N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide?
The canonical SMILES for N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide is CC(C)c1nnc(CCC(=O)NC2CCC(C(F)(F)F)N(C)C2)o1.
What is the InChIKey of N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide?
The InChIKey is YURSVFZPTFEMIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23F3N4O2/c1-9(2)14-21-20-13(24-14)7-6-12(23)19-10-4-5-11(15(16,17)18)22(3)8-10/h9-11H,4-8H2,1-3H3,(H,19,23).
What are the key properties of N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide?
N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide has a molecular weight of 348.37 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-methyl-6-(trifluoromethyl)piperidin-3-yl]-3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanamide is sourced from PubChem (CID 128985941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).