(E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine

C16H20N4O2 — CID 15954159

IUPAC(E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine
SMILESC/C(=N\OCc1nnc(N2CCCCC2)o1)c1ccccc1
InChIInChI=1S/C16H20N4O2/c1-13(14-8-4-2-5-9-14)19-21-12-15-17-18-16(22-15)20-10-6-3-7-11-20/h2,4-5,8-9H,3,6-7,10-12H2,1H3/b19-13+
InChIKeyAMWSDTSAZROIAZ-CPNJWEJPSA-N
MW300.36 g/mol
LogP3.00
Rot. Bonds5

About (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine

(E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine (PubChem CID 15954159) has the molecular formula C16H20N4O2 and a molecular weight of 300.36 g/mol. Its IUPAC name is (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine.

Molecular Properties

Compound Name(E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine
PubChem CID15954159
Molecular FormulaC16H20N4O2
Molecular Weight300.36 g/mol
Exact Mass300.16
IUPAC Name(E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine
SMILESC/C(=N\OCc1nnc(N2CCCCC2)o1)c1ccccc1
InChIInChI=1S/C16H20N4O2/c1-13(14-8-4-2-5-9-14)19-21-12-15-17-18-16(22-15)20-10-6-3-7-11-20/h2,4-5,8-9H,3,6-7,10-12H2,1H3/b19-13+
InChIKeyAMWSDTSAZROIAZ-CPNJWEJPSA-N
XLogP3.00
TPSA63.75 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-[(5-morpholino-1,3,4-oxadiazol-2-yl)methoxy]-1-phenyl-ethanimine
CID 15953920
N-[(5-morpholino-1,3,4-oxadiazol-2-yl)methoxy]-1,1-diphenyl-methanimine
CID 15953921
1,1-diphenyl-N-[[5-(1-piperidyl)-1,3,4-oxadiazol-2-yl]methoxy]methanimine
CID 15954158
1,1-diphenyl-N-[2-[5-(1-piperidyl)-1,3,4-oxadiazol-2-yl]ethoxy]methanimine
CID 15954160
1-phenyl-N-[2-[5-(1-piperidyl)-1,3,4-oxadiazol-2-yl]ethoxy]ethanimine
CID 15954161
N-[2-(5-morpholino-1,3,4-oxadiazol-2-yl)ethoxy]-1-phenyl-ethanimine
CID 15954162
N-benzyl-5-[[(E)-1-phenylethylideneamino]oxymethyl]-1,3,4-oxadiazol-2-amine
CID 15954310
N-allyl-5-[(benzhydrylideneamino)oxymethyl]-1,3,4-oxadiazol-2-amine
CID 15954316
N-allyl-5-[[(E)-1-phenylethylideneamino]oxymethyl]-1,3,4-oxadiazol-2-amine
CID 15954317
N-[(E)-[(Z)-1-[5-[4-[(3-fluorophenyl)methyl]piperidin-1-yl]-1,3,4-oxadiazol-2-yl]but-2-enylidene]amino]-N-methylformamide
CID 155020940
1-(5-Methyl-[1,3,4]oxadiazol-2-yl)-piperidin-4-one O-benzyl-oxime
CID 86656705
1-[5-(Methoxymethyl)-1,3,4-oxadiazol-2-yl]-4-(2-phenylethyl)piperazine
CID 137336900

Frequently Asked Questions

What is the IUPAC name of (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine?
The IUPAC name of (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine (CID 15954159) is (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine.
What is the SMILES notation for (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine?
The canonical SMILES for (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine is C/C(=N\OCc1nnc(N2CCCCC2)o1)c1ccccc1.
What is the InChIKey of (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine?
The InChIKey is AMWSDTSAZROIAZ-CPNJWEJPSA-N. The full InChI is InChI=1S/C16H20N4O2/c1-13(14-8-4-2-5-9-14)19-21-12-15-17-18-16(22-15)20-10-6-3-7-11-20/h2,4-5,8-9H,3,6-7,10-12H2,1H3/b19-13+.
What are the key properties of (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine?
(E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine has a molecular weight of 300.36 g/mol, XLogP of 3.00, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-phenyl-N-[(5-piperidin-1-yl-1,3,4-oxadiazol-2-yl)methoxy]ethanimine is sourced from PubChem (CID 15954159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).