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

C18H19N5O2S — CID 71793531

IUPACN-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(c2nnc(-c3ccsc3)o2)CC1)Nc1cccnc1
InChIInChI=1S/C18H19N5O2S/c24-16(20-15-2-1-6-19-10-15)11-23-7-3-13(4-8-23)17-21-22-18(25-17)14-5-9-26-12-14/h1-2,5-6,9-10,12-13H,3-4,7-8,11H2,(H,20,24)
InChIKeyPALMFQVCIFLVMO-UHFFFAOYSA-N
MW369.45 g/mol
LogP3.01
Rot. Bonds5

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

N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide (PubChem CID 71793531) has the molecular formula C18H19N5O2S and a molecular weight of 369.45 g/mol. Its IUPAC name is N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide
PubChem CID71793531
Molecular FormulaC18H19N5O2S
Molecular Weight369.45 g/mol
Exact Mass369.13
IUPAC NameN-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(c2nnc(-c3ccsc3)o2)CC1)Nc1cccnc1
InChIInChI=1S/C18H19N5O2S/c24-16(20-15-2-1-6-19-10-15)11-23-7-3-13(4-8-23)17-21-22-18(25-17)14-5-9-26-12-14/h1-2,5-6,9-10,12-13H,3-4,7-8,11H2,(H,20,24)
InChIKeyPALMFQVCIFLVMO-UHFFFAOYSA-N
XLogP3.01
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.45
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide?
The IUPAC name of N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide (CID 71793531) is N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide?
The canonical SMILES for N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide is O=C(CN1CCC(c2nnc(-c3ccsc3)o2)CC1)Nc1cccnc1.
What is the InChIKey of N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide?
The InChIKey is PALMFQVCIFLVMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N5O2S/c24-16(20-15-2-1-6-19-10-15)11-23-7-3-13(4-8-23)17-21-22-18(25-17)14-5-9-26-12-14/h1-2,5-6,9-10,12-13H,3-4,7-8,11H2,(H,20,24).
What are the key properties of N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide?
N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide has a molecular weight of 369.45 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-3-yl-2-[4-(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)piperidin-1-yl]acetamide is sourced from PubChem (CID 71793531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).