3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine

C10H16N4O — CID 129216686

IUPAC3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine
SMILESCc1nnc(N2CC3CCC(C2)C3N)o1
InChIInChI=1S/C10H16N4O/c1-6-12-13-10(15-6)14-4-7-2-3-8(5-14)9(7)11/h7-9H,2-5,11H2,1H3
InChIKeyDMTNETVVDKZVDR-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.55
Rot. Bonds1

About 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine

3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine (PubChem CID 129216686) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine.

Molecular Properties

Compound Name3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine
PubChem CID129216686
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine
SMILESCc1nnc(N2CC3CCC(C2)C3N)o1
InChIInChI=1S/C10H16N4O/c1-6-12-13-10(15-6)14-4-7-2-3-8(5-14)9(7)11/h7-9H,2-5,11H2,1H3
InChIKeyDMTNETVVDKZVDR-UHFFFAOYSA-N
XLogP0.55
TPSA68.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine?
The IUPAC name of 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine (CID 129216686) is 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine.
What is the SMILES notation for 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine?
The canonical SMILES for 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine is Cc1nnc(N2CC3CCC(C2)C3N)o1.
What is the InChIKey of 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine?
The InChIKey is DMTNETVVDKZVDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-6-12-13-10(15-6)14-4-7-2-3-8(5-14)9(7)11/h7-9H,2-5,11H2,1H3.
What are the key properties of 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine?
3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine has a molecular weight of 208.26 g/mol, XLogP of 0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-1,3,4-oxadiazol-2-yl)-3-azabicyclo[3.2.1]octan-8-amine is sourced from PubChem (CID 129216686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).