ethane;6-methyl-6-azaspiro[3.4]octan-3-ol

C10H21NO — CID 169236329

IUPACethane;6-methyl-6-azaspiro[3.4]octan-3-ol
SMILESCC.CN1CCC2(CCC2O)C1
InChIInChI=1S/C8H15NO.C2H6/c1-9-5-4-8(6-9)3-2-7(8)10;1-2/h7,10H,2-6H2,1H3;1-2H3
InChIKeyHNKHHNOPOQIUQB-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.49
Rot. Bonds

About ethane;6-methyl-6-azaspiro[3.4]octan-3-ol

ethane;6-methyl-6-azaspiro[3.4]octan-3-ol (PubChem CID 169236329) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is ethane;6-methyl-6-azaspiro[3.4]octan-3-ol.

Molecular Properties

Compound Nameethane;6-methyl-6-azaspiro[3.4]octan-3-ol
PubChem CID169236329
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Nameethane;6-methyl-6-azaspiro[3.4]octan-3-ol
SMILESCC.CN1CCC2(CCC2O)C1
InChIInChI=1S/C8H15NO.C2H6/c1-9-5-4-8(6-9)3-2-7(8)10;1-2/h7,10H,2-6H2,1H3;1-2H3
InChIKeyHNKHHNOPOQIUQB-UHFFFAOYSA-N
XLogP1.49
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethane;6-methyl-6-azaspiro[3.4]octan-3-ol?
The IUPAC name of ethane;6-methyl-6-azaspiro[3.4]octan-3-ol (CID 169236329) is ethane;6-methyl-6-azaspiro[3.4]octan-3-ol.
What is the SMILES notation for ethane;6-methyl-6-azaspiro[3.4]octan-3-ol?
The canonical SMILES for ethane;6-methyl-6-azaspiro[3.4]octan-3-ol is CC.CN1CCC2(CCC2O)C1.
What is the InChIKey of ethane;6-methyl-6-azaspiro[3.4]octan-3-ol?
The InChIKey is HNKHHNOPOQIUQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO.C2H6/c1-9-5-4-8(6-9)3-2-7(8)10;1-2/h7,10H,2-6H2,1H3;1-2H3.
What are the key properties of ethane;6-methyl-6-azaspiro[3.4]octan-3-ol?
ethane;6-methyl-6-azaspiro[3.4]octan-3-ol has a molecular weight of 171.28 g/mol, XLogP of 1.49, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;6-methyl-6-azaspiro[3.4]octan-3-ol is sourced from PubChem (CID 169236329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).