cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone

C15H17N5O2 — CID 53191985

IUPACcyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
SMILESO=C(C1CC1)N1CCCCC1c1nc(-c2cnccn2)no1
InChIInChI=1S/C15H17N5O2/c21-15(10-4-5-10)20-8-2-1-3-12(20)14-18-13(19-22-14)11-9-16-6-7-17-11/h6-7,9-10,12H,1-5,8H2
InChIKeyYWEBQTSROZMCBV-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.99
Rot. Bonds3

About cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone

cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone (PubChem CID 53191985) has the molecular formula C15H17N5O2 and a molecular weight of 299.33 g/mol. Its IUPAC name is cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
PubChem CID53191985
Molecular FormulaC15H17N5O2
Molecular Weight299.33 g/mol
Exact Mass299.14
IUPAC Namecyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone
SMILESO=C(C1CC1)N1CCCCC1c1nc(-c2cnccn2)no1
InChIInChI=1S/C15H17N5O2/c21-15(10-4-5-10)20-8-2-1-3-12(20)14-18-13(19-22-14)11-9-16-6-7-17-11/h6-7,9-10,12H,1-5,8H2
InChIKeyYWEBQTSROZMCBV-UHFFFAOYSA-N
XLogP1.99
TPSA85.01 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone (CID 53191985) is cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone is O=C(C1CC1)N1CCCCC1c1nc(-c2cnccn2)no1.
What is the InChIKey of cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone?
The InChIKey is YWEBQTSROZMCBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5O2/c21-15(10-4-5-10)20-8-2-1-3-12(20)14-18-13(19-22-14)11-9-16-6-7-17-11/h6-7,9-10,12H,1-5,8H2.
What are the key properties of cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone?
cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone has a molecular weight of 299.33 g/mol, XLogP of 1.99, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[2-(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 53191985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).