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

C19H26N4O2 — CID 53159463

IUPACN-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide
SMILESCCCC(=O)NC(Cc1ccccc1)c1nnc(N2CCCCC2)o1
InChIInChI=1S/C19H26N4O2/c1-2-9-17(24)20-16(14-15-10-5-3-6-11-15)18-21-22-19(25-18)23-12-7-4-8-13-23/h3,5-6,10-11,16H,2,4,7-9,12-14H2,1H3,(H,20,24)
InChIKeyQDVCXWSHVJTYEW-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.26
Rot. Bonds7

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

N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide (PubChem CID 53159463) has the molecular formula C19H26N4O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide.

Molecular Properties

Compound NameN-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide
PubChem CID53159463
Molecular FormulaC19H26N4O2
Molecular Weight342.44 g/mol
Exact Mass342.21
IUPAC NameN-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide
SMILESCCCC(=O)NC(Cc1ccccc1)c1nnc(N2CCCCC2)o1
InChIInChI=1S/C19H26N4O2/c1-2-9-17(24)20-16(14-15-10-5-3-6-11-15)18-21-22-19(25-18)23-12-7-4-8-13-23/h3,5-6,10-11,16H,2,4,7-9,12-14H2,1H3,(H,20,24)
InChIKeyQDVCXWSHVJTYEW-UHFFFAOYSA-N
XLogP3.26
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide?
The IUPAC name of N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide (CID 53159463) is N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide.
What is the SMILES notation for N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide?
The canonical SMILES for N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide is CCCC(=O)NC(Cc1ccccc1)c1nnc(N2CCCCC2)o1.
What is the InChIKey of N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide?
The InChIKey is QDVCXWSHVJTYEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O2/c1-2-9-17(24)20-16(14-15-10-5-3-6-11-15)18-21-22-19(25-18)23-12-7-4-8-13-23/h3,5-6,10-11,16H,2,4,7-9,12-14H2,1H3,(H,20,24).
What are the key properties of N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide?
N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide has a molecular weight of 342.44 g/mol, XLogP of 3.26, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-phenyl-1-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)ethyl]butanamide is sourced from PubChem (CID 53159463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).