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

C15H16F3N5O2 — CID 71793494

IUPACN-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(c2nnc(C(F)(F)F)o2)CC1)Nc1cccnc1
InChIInChI=1S/C15H16F3N5O2/c16-15(17,18)14-22-21-13(25-14)10-3-6-23(7-4-10)9-12(24)20-11-2-1-5-19-8-11/h1-2,5,8,10H,3-4,6-7,9H2,(H,20,24)
InChIKeyXYFBPBMLPRHBEP-UHFFFAOYSA-N
MW355.32 g/mol
LogP2.30
Rot. Bonds4

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

N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide (PubChem CID 71793494) has the molecular formula C15H16F3N5O2 and a molecular weight of 355.32 g/mol. Its IUPAC name is N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide
PubChem CID71793494
Molecular FormulaC15H16F3N5O2
Molecular Weight355.32 g/mol
Exact Mass355.13
IUPAC NameN-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(c2nnc(C(F)(F)F)o2)CC1)Nc1cccnc1
InChIInChI=1S/C15H16F3N5O2/c16-15(17,18)14-22-21-13(25-14)10-3-6-23(7-4-10)9-12(24)20-11-2-1-5-19-8-11/h1-2,5,8,10H,3-4,6-7,9H2,(H,20,24)
InChIKeyXYFBPBMLPRHBEP-UHFFFAOYSA-N
XLogP2.30
TPSA84.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.32
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide?
The IUPAC name of N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide (CID 71793494) is N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide.
What is the SMILES notation for N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide?
The canonical SMILES for N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide is O=C(CN1CCC(c2nnc(C(F)(F)F)o2)CC1)Nc1cccnc1.
What is the InChIKey of N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide?
The InChIKey is XYFBPBMLPRHBEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16F3N5O2/c16-15(17,18)14-22-21-13(25-14)10-3-6-23(7-4-10)9-12(24)20-11-2-1-5-19-8-11/h1-2,5,8,10H,3-4,6-7,9H2,(H,20,24).
What are the key properties of N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide?
N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide has a molecular weight of 355.32 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-pyridin-3-yl-2-[4-[5-(trifluoromethyl)-1,3,4-oxadiazol-2-yl]piperidin-1-yl]acetamide is sourced from PubChem (CID 71793494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).