(1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine

C8H13N3O — CID 104880933

IUPAC(1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine
SMILESC[C@@H](N)c1nc(C2CCC2)no1
InChIInChI=1S/C8H13N3O/c1-5(9)8-10-7(11-12-8)6-3-2-4-6/h5-6H,2-4,9H2,1H3/t5-/m1/s1
InChIKeyKJYZVSKUWZWLQB-RXMQYKEDSA-N
MW167.21 g/mol
LogP1.36
Rot. Bonds2

About (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine

(1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine (PubChem CID 104880933) has the molecular formula C8H13N3O and a molecular weight of 167.21 g/mol. Its IUPAC name is (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine.

Molecular Properties

Compound Name(1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine
PubChem CID104880933
Molecular FormulaC8H13N3O
Molecular Weight167.21 g/mol
Exact Mass167.11
IUPAC Name(1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine
SMILESC[C@@H](N)c1nc(C2CCC2)no1
InChIInChI=1S/C8H13N3O/c1-5(9)8-10-7(11-12-8)6-3-2-4-6/h5-6H,2-4,9H2,1H3/t5-/m1/s1
InChIKeyKJYZVSKUWZWLQB-RXMQYKEDSA-N
XLogP1.36
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-2-methylpropan-1-amine
CID 64981709
(1S)-1-[3-(4,4-dimethylcyclohexyl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 104899801
(1R)-1-[3-(3-ethylcyclohexyl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 104899805
(1S,2R)-1-amino-1-(3-cycloheptyl-1,2,4-oxadiazol-5-yl)propan-2-ol
CID 104965493
(1S)-1-(3-cyclopentyl-1,2,4-oxadiazol-5-yl)-2,2-dimethylpropan-1-amine
CID 93357432
1-[3-(4-propylcyclohexyl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 65422874
1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)-N-methylethanamine
CID 64982322
(3-cycloheptyl-1,2,4-oxadiazol-5-yl)-cyclohexylmethanamine
CID 65389317
(1S)-1-[3-(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 104881230
1-[3-(thiolan-3-yl)-1,2,4-oxadiazol-5-yl]ethanamine
CID 115080972
5-[1-(azetidin-3-yl)ethyl]-3-cyclooctyl-1,2,4-oxadiazole
CID 116682608
(2S)-2-amino-2-(3-cyclooctyl-1,2,4-oxadiazol-5-yl)ethanol
CID 104915877

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine?
The IUPAC name of (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine (CID 104880933) is (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine.
What is the SMILES notation for (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine?
The canonical SMILES for (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine is C[C@@H](N)c1nc(C2CCC2)no1.
What is the InChIKey of (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine?
The InChIKey is KJYZVSKUWZWLQB-RXMQYKEDSA-N. The full InChI is InChI=1S/C8H13N3O/c1-5(9)8-10-7(11-12-8)6-3-2-4-6/h5-6H,2-4,9H2,1H3/t5-/m1/s1.
What are the key properties of (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine?
(1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine has a molecular weight of 167.21 g/mol, XLogP of 1.36, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(3-cyclobutyl-1,2,4-oxadiazol-5-yl)ethanamine is sourced from PubChem (CID 104880933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).