(8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol

C11H22N2O — CID 166567362

IUPAC(8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol
SMILESCN1CC[C@@H](O)C12CN(C(C)(C)C)C2
InChIInChI=1S/C11H22N2O/c1-10(2,3)13-7-11(8-13)9(14)5-6-12(11)4/h9,14H,5-8H2,1-4H3/t9-/m1/s1
InChIKeyBSYVYLFZISIBAG-SECBINFHSA-N
MW198.31 g/mol
LogP0.54
Rot. Bonds

About (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol

(8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol (PubChem CID 166567362) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol.

Molecular Properties

Compound Name(8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol
PubChem CID166567362
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name(8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol
SMILESCN1CC[C@@H](O)C12CN(C(C)(C)C)C2
InChIInChI=1S/C11H22N2O/c1-10(2,3)13-7-11(8-13)9(14)5-6-12(11)4/h9,14H,5-8H2,1-4H3/t9-/m1/s1
InChIKeyBSYVYLFZISIBAG-SECBINFHSA-N
XLogP0.54
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol?
The IUPAC name of (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol (CID 166567362) is (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol.
What is the SMILES notation for (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol?
The canonical SMILES for (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol is CN1CC[C@@H](O)C12CN(C(C)(C)C)C2.
What is the InChIKey of (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol?
The InChIKey is BSYVYLFZISIBAG-SECBINFHSA-N. The full InChI is InChI=1S/C11H22N2O/c1-10(2,3)13-7-11(8-13)9(14)5-6-12(11)4/h9,14H,5-8H2,1-4H3/t9-/m1/s1.
What are the key properties of (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol?
(8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol has a molecular weight of 198.31 g/mol, XLogP of 0.54, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-2-tert-butyl-5-methyl-2,5-diazaspiro[3.4]octan-8-ol is sourced from PubChem (CID 166567362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).