N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide

C20H20N4O2 — CID 53181954

IUPACN-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide
SMILESO=C(NC1(c2nc(-c3ccccn3)no2)CCCCC1)c1ccccc1
InChIInChI=1S/C20H20N4O2/c25-18(15-9-3-1-4-10-15)23-20(12-6-2-7-13-20)19-22-17(24-26-19)16-11-5-8-14-21-16/h1,3-5,8-11,14H,2,6-7,12-13H2,(H,23,25)
InChIKeyHYPKKVCSESEODP-UHFFFAOYSA-N
MW348.41 g/mol
LogP3.72
Rot. Bonds4

About N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide

N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide (PubChem CID 53181954) has the molecular formula C20H20N4O2 and a molecular weight of 348.41 g/mol. Its IUPAC name is N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide.

Molecular Properties

Compound NameN-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide
PubChem CID53181954
Molecular FormulaC20H20N4O2
Molecular Weight348.41 g/mol
Exact Mass348.16
IUPAC NameN-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide
SMILESO=C(NC1(c2nc(-c3ccccn3)no2)CCCCC1)c1ccccc1
InChIInChI=1S/C20H20N4O2/c25-18(15-9-3-1-4-10-15)23-20(12-6-2-7-13-20)19-22-17(24-26-19)16-11-5-8-14-21-16/h1,3-5,8-11,14H,2,6-7,12-13H2,(H,23,25)
InChIKeyHYPKKVCSESEODP-UHFFFAOYSA-N
XLogP3.72
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.41
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide?
The IUPAC name of N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide (CID 53181954) is N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide.
What is the SMILES notation for N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide?
The canonical SMILES for N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide is O=C(NC1(c2nc(-c3ccccn3)no2)CCCCC1)c1ccccc1.
What is the InChIKey of N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide?
The InChIKey is HYPKKVCSESEODP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O2/c25-18(15-9-3-1-4-10-15)23-20(12-6-2-7-13-20)19-22-17(24-26-19)16-11-5-8-14-21-16/h1,3-5,8-11,14H,2,6-7,12-13H2,(H,23,25).
What are the key properties of N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide?
N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide has a molecular weight of 348.41 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-pyridin-2-yl-1,2,4-oxadiazol-5-yl)cyclohexyl]benzamide is sourced from PubChem (CID 53181954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).