1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol

C8H14N4O2 — CID 106967902

IUPAC1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol
SMILESNCc1nnc(N2CCC(O)CC2)o1
InChIInChI=1S/C8H14N4O2/c9-5-7-10-11-8(14-7)12-3-1-6(13)2-4-12/h6,13H,1-5,9H2
InChIKeyZNAUBQTWBBJDFZ-UHFFFAOYSA-N
MW198.23 g/mol
LogP-0.51
Rot. Bonds2

About 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol

1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol (PubChem CID 106967902) has the molecular formula C8H14N4O2 and a molecular weight of 198.23 g/mol. Its IUPAC name is 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol.

Molecular Properties

Compound Name1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol
PubChem CID106967902
Molecular FormulaC8H14N4O2
Molecular Weight198.23 g/mol
Exact Mass198.11
IUPAC Name1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol
SMILESNCc1nnc(N2CCC(O)CC2)o1
InChIInChI=1S/C8H14N4O2/c9-5-7-10-11-8(14-7)12-3-1-6(13)2-4-12/h6,13H,1-5,9H2
InChIKeyZNAUBQTWBBJDFZ-UHFFFAOYSA-N
XLogP-0.51
TPSA88.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

[1-[5-(2-aminoethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-yl]methanol
CID 106968372
[5-(1,1-dioxo-1,4-thiazinan-4-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 106969301
1-[5-(ethylaminomethyl)-1,3,4-oxadiazol-2-yl]pyrrolidin-3-ol
CID 106960694
2-[5-(4-tert-butylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 106960391
[5-(3-ethylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 106969278
[5-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-1,3,4-oxadiazol-2-yl]methanamine
CID 106965911
1-[5-[(cyclopropylamino)methyl]-1,3,4-oxadiazol-2-yl]piperidine-4-carboxamide
CID 106967817
[5-[3-(trifluoromethyl)piperidin-1-yl]-1,3,4-oxadiazol-2-yl]methanamine
CID 106962468
[1-[5-(2-chloroethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-yl]methanol
CID 106956508
N-[[5-(4-methylpiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methyl]ethanamine
CID 106967471
2-[5-(4-ethylazepan-1-yl)-1,3,4-oxadiazol-2-yl]ethanamine
CID 106962400
[5-(3-propoxypiperidin-1-yl)-1,3,4-oxadiazol-2-yl]methanamine
CID 106960042

Frequently Asked Questions

What is the IUPAC name of 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol?
The IUPAC name of 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol (CID 106967902) is 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol.
What is the SMILES notation for 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol?
The canonical SMILES for 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol is NCc1nnc(N2CCC(O)CC2)o1.
What is the InChIKey of 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol?
The InChIKey is ZNAUBQTWBBJDFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N4O2/c9-5-7-10-11-8(14-7)12-3-1-6(13)2-4-12/h6,13H,1-5,9H2.
What are the key properties of 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol?
1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol has a molecular weight of 198.23 g/mol, XLogP of -0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(aminomethyl)-1,3,4-oxadiazol-2-yl]piperidin-4-ol is sourced from PubChem (CID 106967902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).