5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine

C9H16N4O2 — CID 65418361

IUPAC5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine
SMILESNc1noc(CCOC2CCNCC2)n1
InChIInChI=1S/C9H16N4O2/c10-9-12-8(15-13-9)3-6-14-7-1-4-11-5-2-7/h7,11H,1-6H2,(H2,10,13)
InChIKeyMPBYWJOUOPKQNX-UHFFFAOYSA-N
MW212.25 g/mol
LogP-0.04
Rot. Bonds4

About 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine

5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine (PubChem CID 65418361) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine.

Molecular Properties

Compound Name5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine
PubChem CID65418361
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine
SMILESNc1noc(CCOC2CCNCC2)n1
InChIInChI=1S/C9H16N4O2/c10-9-12-8(15-13-9)3-6-14-7-1-4-11-5-2-7/h7,11H,1-6H2,(H2,10,13)
InChIKeyMPBYWJOUOPKQNX-UHFFFAOYSA-N
XLogP-0.04
TPSA86.20 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-(2,2-dimethylcyclopropyl)-5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazole
CID 104880792
N,N-dimethyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 115345496
3-(1-methoxypropyl)-5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazole
CID 116701753
N-cyclopropyl-5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazole-3-carboxamide
CID 102790886
4-methyl-2-[5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 79071496
3-[(4-methyl-1,3-thiazol-2-yl)methyl]-5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazole
CID 63869406
2-(2-piperidin-4-yloxyethyl)-1,3-benzoxazole
CID 63870416
5-(2-piperidin-3-ylethyl)-1,2,4-oxadiazol-3-amine
CID 65419210
5,7-dichloro-2-(2-piperidin-4-yloxyethyl)-1,3-benzoxazole
CID 107676158
5-fluoro-2-(2-piperidin-4-yloxyethyl)-1,3-benzoxazole
CID 64792495
3-(oxolan-3-yl)-5-(piperidin-4-yloxymethyl)-1,2,4-oxadiazole
CID 65330329
N,N-diethyl-2-[5-(piperidin-4-yloxymethyl)-1,2,4-oxadiazol-3-yl]ethanamine
CID 63871053

Frequently Asked Questions

What is the IUPAC name of 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine?
The IUPAC name of 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine (CID 65418361) is 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine.
What is the SMILES notation for 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine?
The canonical SMILES for 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine is Nc1noc(CCOC2CCNCC2)n1.
What is the InChIKey of 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine?
The InChIKey is MPBYWJOUOPKQNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2/c10-9-12-8(15-13-9)3-6-14-7-1-4-11-5-2-7/h7,11H,1-6H2,(H2,10,13).
What are the key properties of 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine?
5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine has a molecular weight of 212.25 g/mol, XLogP of -0.04, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-piperidin-4-yloxyethyl)-1,2,4-oxadiazol-3-amine is sourced from PubChem (CID 65418361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).