N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide

C19H30N4O3 — CID 91918730

IUPACN-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCC(c2nc(C3CCOCC3)no2)CC1
InChIInChI=1S/C19H30N4O3/c24-19(20-16-4-2-1-3-5-16)23-10-6-15(7-11-23)18-21-17(22-26-18)14-8-12-25-13-9-14/h14-16H,1-13H2,(H,20,24)
InChIKeyXXTDARYFONFUKW-UHFFFAOYSA-N
MW362.47 g/mol
LogP3.19
Rot. Bonds3

About N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide

N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide (PubChem CID 91918730) has the molecular formula C19H30N4O3 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide
PubChem CID91918730
Molecular FormulaC19H30N4O3
Molecular Weight362.47 g/mol
Exact Mass362.23
IUPAC NameN-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide
SMILESO=C(NC1CCCCC1)N1CCC(c2nc(C3CCOCC3)no2)CC1
InChIInChI=1S/C19H30N4O3/c24-19(20-16-4-2-1-3-5-16)23-10-6-15(7-11-23)18-21-17(22-26-18)14-8-12-25-13-9-14/h14-16H,1-13H2,(H,20,24)
InChIKeyXXTDARYFONFUKW-UHFFFAOYSA-N
XLogP3.19
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide?
The IUPAC name of N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide (CID 91918730) is N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide?
The canonical SMILES for N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide is O=C(NC1CCCCC1)N1CCC(c2nc(C3CCOCC3)no2)CC1.
What is the InChIKey of N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide?
The InChIKey is XXTDARYFONFUKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H30N4O3/c24-19(20-16-4-2-1-3-5-16)23-10-6-15(7-11-23)18-21-17(22-26-18)14-8-12-25-13-9-14/h14-16H,1-13H2,(H,20,24).
What are the key properties of N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide?
N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide has a molecular weight of 362.47 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[3-(oxan-4-yl)-1,2,4-oxadiazol-5-yl]piperidine-1-carboxamide is sourced from PubChem (CID 91918730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).