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

C15H24N4O4 — CID 118764200

IUPAC1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide
SMILESCCOCC(=O)N1CCC(C(=O)N(C)CCc2ncon2)CC1
InChIInChI=1S/C15H24N4O4/c1-3-22-10-14(20)19-8-4-12(5-9-19)15(21)18(2)7-6-13-16-11-23-17-13/h11-12H,3-10H2,1-2H3
InChIKeyLQAUBOXCHBBSDS-UHFFFAOYSA-N
MW324.38 g/mol
LogP0.35
Rot. Bonds7

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

1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide (PubChem CID 118764200) has the molecular formula C15H24N4O4 and a molecular weight of 324.38 g/mol. Its IUPAC name is 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide
PubChem CID118764200
Molecular FormulaC15H24N4O4
Molecular Weight324.38 g/mol
Exact Mass324.18
IUPAC Name1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide
SMILESCCOCC(=O)N1CCC(C(=O)N(C)CCc2ncon2)CC1
InChIInChI=1S/C15H24N4O4/c1-3-22-10-14(20)19-8-4-12(5-9-19)15(21)18(2)7-6-13-16-11-23-17-13/h11-12H,3-10H2,1-2H3
InChIKeyLQAUBOXCHBBSDS-UHFFFAOYSA-N
XLogP0.35
TPSA88.77 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.38
LogP ≤ 50.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide (CID 118764200) is 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide is CCOCC(=O)N1CCC(C(=O)N(C)CCc2ncon2)CC1.
What is the InChIKey of 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide?
The InChIKey is LQAUBOXCHBBSDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O4/c1-3-22-10-14(20)19-8-4-12(5-9-19)15(21)18(2)7-6-13-16-11-23-17-13/h11-12H,3-10H2,1-2H3.
What are the key properties of 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide?
1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide has a molecular weight of 324.38 g/mol, XLogP of 0.35, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyacetyl)-N-methyl-N-[2-(1,2,4-oxadiazol-3-yl)ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 118764200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).