2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide

C20H28N4O2 — CID 53159461

IUPAC2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide
SMILESCC(C)(C)C(=O)NC(Cc1ccccc1)c1nnc(N2CCCCC2)o1
InChIInChI=1S/C20H28N4O2/c1-20(2,3)18(25)21-16(14-15-10-6-4-7-11-15)17-22-23-19(26-17)24-12-8-5-9-13-24/h4,6-7,10-11,16H,5,8-9,12-14H2,1-3H3,(H,21,25)
InChIKeyXCESZFFKZIKZNN-UHFFFAOYSA-N
MW356.47 g/mol
LogP3.51
Rot. Bonds5

About 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide

2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide (PubChem CID 53159461) has the molecular formula C20H28N4O2 and a molecular weight of 356.47 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide
PubChem CID53159461
Molecular FormulaC20H28N4O2
Molecular Weight356.47 g/mol
Exact Mass356.22
IUPAC Name2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide
SMILESCC(C)(C)C(=O)NC(Cc1ccccc1)c1nnc(N2CCCCC2)o1
InChIInChI=1S/C20H28N4O2/c1-20(2,3)18(25)21-16(14-15-10-6-4-7-11-15)17-22-23-19(26-17)24-12-8-5-9-13-24/h4,6-7,10-11,16H,5,8-9,12-14H2,1-3H3,(H,21,25)
InChIKeyXCESZFFKZIKZNN-UHFFFAOYSA-N
XLogP3.51
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.47
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide (CID 53159461) is 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide is CC(C)(C)C(=O)NC(Cc1ccccc1)c1nnc(N2CCCCC2)o1.
What is the InChIKey of 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide?
The InChIKey is XCESZFFKZIKZNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H28N4O2/c1-20(2,3)18(25)21-16(14-15-10-6-4-7-11-15)17-22-23-19(26-17)24-12-8-5-9-13-24/h4,6-7,10-11,16H,5,8-9,12-14H2,1-3H3,(H,21,25).
What are the key properties of 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide?
2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide has a molecular weight of 356.47 g/mol, XLogP of 3.51, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]propanamide is sourced from PubChem (CID 53159461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).