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

C14H17N5O2 — CID 33357885

IUPACN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide
SMILESCc1nc(C2(NC(=O)c3cnccn3)CCCCC2)no1
InChIInChI=1S/C14H17N5O2/c1-10-17-13(19-21-10)14(5-3-2-4-6-14)18-12(20)11-9-15-7-8-16-11/h7-9H,2-6H2,1H3,(H,18,20)
InChIKeyYFJAPGFHHVOCSG-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.76
Rot. Bonds3

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

N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide (PubChem CID 33357885) has the molecular formula C14H17N5O2 and a molecular weight of 287.32 g/mol. Its IUPAC name is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide
PubChem CID33357885
Molecular FormulaC14H17N5O2
Molecular Weight287.32 g/mol
Exact Mass287.14
IUPAC NameN-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide
SMILESCc1nc(C2(NC(=O)c3cnccn3)CCCCC2)no1
InChIInChI=1S/C14H17N5O2/c1-10-17-13(19-21-10)14(5-3-2-4-6-14)18-12(20)11-9-15-7-8-16-11/h7-9H,2-6H2,1H3,(H,18,20)
InChIKeyYFJAPGFHHVOCSG-UHFFFAOYSA-N
XLogP1.76
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide?
The IUPAC name of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide (CID 33357885) is N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide is Cc1nc(C2(NC(=O)c3cnccn3)CCCCC2)no1.
What is the InChIKey of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide?
The InChIKey is YFJAPGFHHVOCSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O2/c1-10-17-13(19-21-10)14(5-3-2-4-6-14)18-12(20)11-9-15-7-8-16-11/h7-9H,2-6H2,1H3,(H,18,20).
What are the key properties of N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide?
N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide has a molecular weight of 287.32 g/mol, XLogP of 1.76, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(5-methyl-1,2,4-oxadiazol-3-yl)cyclohexyl]pyrazine-2-carboxamide is sourced from PubChem (CID 33357885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).