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

C16H20N4O2 — CID 53159682

IUPACN-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide
SMILESCC(=O)NC(c1ccccc1)c1nnc(N2CCCCC2)o1
InChIInChI=1S/C16H20N4O2/c1-12(21)17-14(13-8-4-2-5-9-13)15-18-19-16(22-15)20-10-6-3-7-11-20/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3,(H,17,21)
InChIKeyWPGKJOIMKQULTF-UHFFFAOYSA-N
MW300.36 g/mol
LogP2.29
Rot. Bonds4

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

N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide (PubChem CID 53159682) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide.

Molecular Properties

Compound NameN-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide
PubChem CID53159682
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC NameN-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide
SMILESCC(=O)NC(c1ccccc1)c1nnc(N2CCCCC2)o1
InChIInChI=1S/C16H20N4O2/c1-12(21)17-14(13-8-4-2-5-9-13)15-18-19-16(22-15)20-10-6-3-7-11-20/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3,(H,17,21)
InChIKeyWPGKJOIMKQULTF-UHFFFAOYSA-N
XLogP2.29
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide?
The IUPAC name of N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide (CID 53159682) is N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide.
What is the SMILES notation for N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide?
The canonical SMILES for N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide is CC(=O)NC(c1ccccc1)c1nnc(N2CCCCC2)o1.
What is the InChIKey of N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide?
The InChIKey is WPGKJOIMKQULTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-12(21)17-14(13-8-4-2-5-9-13)15-18-19-16(22-15)20-10-6-3-7-11-20/h2,4-5,8-9,14H,3,6-7,10-11H2,1H3,(H,17,21).
What are the key properties of N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide?
N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide has a molecular weight of 300.36 g/mol, XLogP of 2.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[phenyl-(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methyl]acetamide is sourced from PubChem (CID 53159682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).