5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole

C14H26N4O — CID 106421628

IUPAC5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole
SMILESCCCC1CN(CCc2nc(C)no2)C(CC)CN1
InChIInChI=1S/C14H26N4O/c1-4-6-12-10-18(13(5-2)9-15-12)8-7-14-16-11(3)17-19-14/h12-13,15H,4-10H2,1-3H3
InChIKeyFWBWTUPKUAYEHO-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.77
Rot. Bonds6

About 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole

5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole (PubChem CID 106421628) has the molecular formula C14H26N4O and a molecular weight of 266.39 g/mol. Its IUPAC name is 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole.

Molecular Properties

Compound Name5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole
PubChem CID106421628
Molecular FormulaC14H26N4O
Molecular Weight266.39 g/mol
Exact Mass266.21
IUPAC Name5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole
SMILESCCCC1CN(CCc2nc(C)no2)C(CC)CN1
InChIInChI=1S/C14H26N4O/c1-4-6-12-10-18(13(5-2)9-15-12)8-7-14-16-11(3)17-19-14/h12-13,15H,4-10H2,1-3H3
InChIKeyFWBWTUPKUAYEHO-UHFFFAOYSA-N
XLogP1.77
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-5-methyl-1,2,4-oxadiazole
CID 106421459
5-[2-(2-ethylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole
CID 106421703
4-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-2-methyl-1,3-thiazole
CID 106043590
5-[(2,5-diethylpiperazin-1-yl)methyl]-3-propyl-1,2,4-oxadiazole
CID 64978637
4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine
CID 64945783
1-(2-ethoxyethyl)-2-ethyl-5-propylpiperazine
CID 64846765
5-[(2-ethyl-5,5-dimethylpiperazin-1-yl)methyl]-3-methyl-1,2,4-oxadiazole
CID 64946367
1-(2-cyclohexyloxyethyl)-2-ethyl-5-propylpiperazine
CID 64942384
2-ethyl-1-methyl-5-propylpiperazine
CID 64846947
2-ethyl-1-[(4-methoxy-6-methyl-2-pyridinyl)methyl]-5-propylpiperazine
CID 82884970
2-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-5-methylpyrazine
CID 64941741
5-[(2,5-diethylpiperazin-1-yl)methyl]-3-propan-2-yl-1,2,4-oxadiazole
CID 64978789

Frequently Asked Questions

What is the IUPAC name of 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole?
The IUPAC name of 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole (CID 106421628) is 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole.
What is the SMILES notation for 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole?
The canonical SMILES for 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole is CCCC1CN(CCc2nc(C)no2)C(CC)CN1.
What is the InChIKey of 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole?
The InChIKey is FWBWTUPKUAYEHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N4O/c1-4-6-12-10-18(13(5-2)9-15-12)8-7-14-16-11(3)17-19-14/h12-13,15H,4-10H2,1-3H3.
What are the key properties of 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole?
5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole has a molecular weight of 266.39 g/mol, XLogP of 1.77, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(2-ethyl-5-propylpiperazin-1-yl)ethyl]-3-methyl-1,2,4-oxadiazole is sourced from PubChem (CID 106421628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).