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

C18H28N4O3 — CID 72884711

IUPAC1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide
SMILESCCC(NC(=O)C1CCN(C(=O)C2CCCC2)CC1)c1nc(C)no1
InChIInChI=1S/C18H28N4O3/c1-3-15(17-19-12(2)21-25-17)20-16(23)13-8-10-22(11-9-13)18(24)14-6-4-5-7-14/h13-15H,3-11H2,1-2H3,(H,20,23)
InChIKeyPUXOIIPKDPLSIM-UHFFFAOYSA-N
MW348.45 g/mol
LogP2.37
Rot. Bonds5

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

1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide (PubChem CID 72884711) has the molecular formula C18H28N4O3 and a molecular weight of 348.45 g/mol. Its IUPAC name is 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide
PubChem CID72884711
Molecular FormulaC18H28N4O3
Molecular Weight348.45 g/mol
Exact Mass348.22
IUPAC Name1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide
SMILESCCC(NC(=O)C1CCN(C(=O)C2CCCC2)CC1)c1nc(C)no1
InChIInChI=1S/C18H28N4O3/c1-3-15(17-19-12(2)21-25-17)20-16(23)13-8-10-22(11-9-13)18(24)14-6-4-5-7-14/h13-15H,3-11H2,1-2H3,(H,20,23)
InChIKeyPUXOIIPKDPLSIM-UHFFFAOYSA-N
XLogP2.37
TPSA88.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide?
The IUPAC name of 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide (CID 72884711) is 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide is CCC(NC(=O)C1CCN(C(=O)C2CCCC2)CC1)c1nc(C)no1.
What is the InChIKey of 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide?
The InChIKey is PUXOIIPKDPLSIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O3/c1-3-15(17-19-12(2)21-25-17)20-16(23)13-8-10-22(11-9-13)18(24)14-6-4-5-7-14/h13-15H,3-11H2,1-2H3,(H,20,23).
What are the key properties of 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide?
1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide has a molecular weight of 348.45 g/mol, XLogP of 2.37, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentanecarbonyl)-N-[1-(3-methyl-1,2,4-oxadiazol-5-yl)propyl]piperidine-4-carboxamide is sourced from PubChem (CID 72884711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).