N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide

C19H25FN4O2 — CID 55922159

IUPACN-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide
SMILESCc1nnc(C(C)N2CCC(C(=O)NCCc3ccccc3F)CC2)o1
InChIInChI=1S/C19H25FN4O2/c1-13(19-23-22-14(2)26-19)24-11-8-16(9-12-24)18(25)21-10-7-15-5-3-4-6-17(15)20/h3-6,13,16H,7-12H2,1-2H3,(H,21,25)
InChIKeyAYPFNFQNAWIDFR-UHFFFAOYSA-N
MW360.43 g/mol
LogP2.65
Rot. Bonds6

About N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide

N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide (PubChem CID 55922159) has the molecular formula C19H25FN4O2 and a molecular weight of 360.43 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide
PubChem CID55922159
Molecular FormulaC19H25FN4O2
Molecular Weight360.43 g/mol
Exact Mass360.20
IUPAC NameN-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide
SMILESCc1nnc(C(C)N2CCC(C(=O)NCCc3ccccc3F)CC2)o1
InChIInChI=1S/C19H25FN4O2/c1-13(19-23-22-14(2)26-19)24-11-8-16(9-12-24)18(25)21-10-7-15-5-3-4-6-17(15)20/h3-6,13,16H,7-12H2,1-2H3,(H,21,25)
InChIKeyAYPFNFQNAWIDFR-UHFFFAOYSA-N
XLogP2.65
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.43
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide (CID 55922159) is N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide is Cc1nnc(C(C)N2CCC(C(=O)NCCc3ccccc3F)CC2)o1.
What is the InChIKey of N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide?
The InChIKey is AYPFNFQNAWIDFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN4O2/c1-13(19-23-22-14(2)26-19)24-11-8-16(9-12-24)18(25)21-10-7-15-5-3-4-6-17(15)20/h3-6,13,16H,7-12H2,1-2H3,(H,21,25).
What are the key properties of N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide?
N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide has a molecular weight of 360.43 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)ethyl]-1-[1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 55922159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).