2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol

C15H23N5O2 — CID 51104633

IUPAC2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol
SMILESCCc1noc(CN2CCC(c3ccnn3CCO)CC2)n1
InChIInChI=1S/C15H23N5O2/c1-2-14-17-15(22-18-14)11-19-7-4-12(5-8-19)13-3-6-16-20(13)9-10-21/h3,6,12,21H,2,4-5,7-11H2,1H3
InChIKeyUZJUBEFWPITWEY-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.20
Rot. Bonds6

About 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol

2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol (PubChem CID 51104633) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol.

Molecular Properties

Compound Name2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol
PubChem CID51104633
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC Name2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol
SMILESCCc1noc(CN2CCC(c3ccnn3CCO)CC2)n1
InChIInChI=1S/C15H23N5O2/c1-2-14-17-15(22-18-14)11-19-7-4-12(5-8-19)13-3-6-16-20(13)9-10-21/h3,6,12,21H,2,4-5,7-11H2,1H3
InChIKeyUZJUBEFWPITWEY-UHFFFAOYSA-N
XLogP1.20
TPSA80.21 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol?
The IUPAC name of 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol (CID 51104633) is 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol.
What is the SMILES notation for 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol?
The canonical SMILES for 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol is CCc1noc(CN2CCC(c3ccnn3CCO)CC2)n1.
What is the InChIKey of 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol?
The InChIKey is UZJUBEFWPITWEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c1-2-14-17-15(22-18-14)11-19-7-4-12(5-8-19)13-3-6-16-20(13)9-10-21/h3,6,12,21H,2,4-5,7-11H2,1H3.
What are the key properties of 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol?
2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol has a molecular weight of 305.38 g/mol, XLogP of 1.20, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-[1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]piperidin-4-yl]pyrazol-1-yl]ethanol is sourced from PubChem (CID 51104633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).