1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine

C15H20N4O — CID 28713194

IUPAC1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine
SMILESCCN1CCC(Nc2ccc(-c3nnco3)cc2)CC1
InChIInChI=1S/C15H20N4O/c1-2-19-9-7-14(8-10-19)17-13-5-3-12(4-6-13)15-18-16-11-20-15/h3-6,11,14,17H,2,7-10H2,1H3
InChIKeyDXGFAPCPHGKZCW-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.63
Rot. Bonds4

About 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine

1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine (PubChem CID 28713194) has the molecular formula C15H20N4O and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine
PubChem CID28713194
Molecular FormulaC15H20N4O
Molecular Weight272.35 g/mol
Exact Mass272.16
IUPAC Name1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine
SMILESCCN1CCC(Nc2ccc(-c3nnco3)cc2)CC1
InChIInChI=1S/C15H20N4O/c1-2-19-9-7-14(8-10-19)17-13-5-3-12(4-6-13)15-18-16-11-20-15/h3-6,11,14,17H,2,7-10H2,1H3
InChIKeyDXGFAPCPHGKZCW-UHFFFAOYSA-N
XLogP2.63
TPSA54.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine?
The IUPAC name of 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine (CID 28713194) is 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine is CCN1CCC(Nc2ccc(-c3nnco3)cc2)CC1.
What is the InChIKey of 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine?
The InChIKey is DXGFAPCPHGKZCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O/c1-2-19-9-7-14(8-10-19)17-13-5-3-12(4-6-13)15-18-16-11-20-15/h3-6,11,14,17H,2,7-10H2,1H3.
What are the key properties of 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine?
1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine has a molecular weight of 272.35 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[4-(1,3,4-oxadiazol-2-yl)phenyl]piperidin-4-amine is sourced from PubChem (CID 28713194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).