1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine

C11H20N4O — CID 104635994

IUPAC1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine
SMILESCCc1nc(C(N)CN2CCCCC2)no1
InChIInChI=1S/C11H20N4O/c1-2-10-13-11(14-16-10)9(12)8-15-6-4-3-5-7-15/h9H,2-8,12H2,1H3
InChIKeyCCHIEANPNWSFKA-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.12
Rot. Bonds4

About 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine

1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine (PubChem CID 104635994) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine.

Molecular Properties

Compound Name1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine
PubChem CID104635994
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine
SMILESCCc1nc(C(N)CN2CCCCC2)no1
InChIInChI=1S/C11H20N4O/c1-2-10-13-11(14-16-10)9(12)8-15-6-4-3-5-7-15/h9H,2-8,12H2,1H3
InChIKeyCCHIEANPNWSFKA-UHFFFAOYSA-N
XLogP1.12
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine?
The IUPAC name of 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine (CID 104635994) is 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine.
What is the SMILES notation for 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine?
The canonical SMILES for 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine is CCc1nc(C(N)CN2CCCCC2)no1.
What is the InChIKey of 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine?
The InChIKey is CCHIEANPNWSFKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O/c1-2-10-13-11(14-16-10)9(12)8-15-6-4-3-5-7-15/h9H,2-8,12H2,1H3.
What are the key properties of 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine?
1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine has a molecular weight of 224.31 g/mol, XLogP of 1.12, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethyl-1,2,4-oxadiazol-3-yl)-2-piperidin-1-ylethanamine is sourced from PubChem (CID 104635994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).