1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine

C11H21N3O — CID 68917606

IUPAC1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)c1nnc(C(N)C(C)(C)C)o1
InChIInChI=1S/C11H21N3O/c1-10(2,3)7(12)8-13-14-9(15-8)11(4,5)6/h7H,12H2,1-6H3
InChIKeyUOEBEHIZKBLEKM-UHFFFAOYSA-N
MW211.31 g/mol
LogP2.41
Rot. Bonds1

About 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine

1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine (PubChem CID 68917606) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine.

Molecular Properties

Compound Name1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine
PubChem CID68917606
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC Name1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine
SMILESCC(C)(C)c1nnc(C(N)C(C)(C)C)o1
InChIInChI=1S/C11H21N3O/c1-10(2,3)7(12)8-13-14-9(15-8)11(4,5)6/h7H,12H2,1-6H3
InChIKeyUOEBEHIZKBLEKM-UHFFFAOYSA-N
XLogP2.41
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine?
The IUPAC name of 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine (CID 68917606) is 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine.
What is the SMILES notation for 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine?
The canonical SMILES for 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine is CC(C)(C)c1nnc(C(N)C(C)(C)C)o1.
What is the InChIKey of 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine?
The InChIKey is UOEBEHIZKBLEKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-10(2,3)7(12)8-13-14-9(15-8)11(4,5)6/h7H,12H2,1-6H3.
What are the key properties of 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine?
1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine has a molecular weight of 211.31 g/mol, XLogP of 2.41, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-tert-butyl-1,3,4-oxadiazol-2-yl)-2,2-dimethylpropan-1-amine is sourced from PubChem (CID 68917606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).