3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol

C11H21NO2 — CID 171953073

IUPAC3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol
SMILESCOCC1(O)CC2CCCC(C1)N2C
InChIInChI=1S/C11H21NO2/c1-12-9-4-3-5-10(12)7-11(13,6-9)8-14-2/h9-10,13H,3-8H2,1-2H3
InChIKeyZXKIDODAXPTDBF-UHFFFAOYSA-N
MW199.29 g/mol
LogP1.01
Rot. Bonds2

About 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol

3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol (PubChem CID 171953073) has the molecular formula C11H21NO2 and a molecular weight of 199.29 g/mol. Its IUPAC name is 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol.

Molecular Properties

Compound Name3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol
PubChem CID171953073
Molecular FormulaC11H21NO2
Molecular Weight199.29 g/mol
Exact Mass199.16
IUPAC Name3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol
SMILESCOCC1(O)CC2CCCC(C1)N2C
InChIInChI=1S/C11H21NO2/c1-12-9-4-3-5-10(12)7-11(13,6-9)8-14-2/h9-10,13H,3-8H2,1-2H3
InChIKeyZXKIDODAXPTDBF-UHFFFAOYSA-N
XLogP1.01
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.29
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol?
The IUPAC name of 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol (CID 171953073) is 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol.
What is the SMILES notation for 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol?
The canonical SMILES for 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol is COCC1(O)CC2CCCC(C1)N2C.
What is the InChIKey of 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol?
The InChIKey is ZXKIDODAXPTDBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO2/c1-12-9-4-3-5-10(12)7-11(13,6-9)8-14-2/h9-10,13H,3-8H2,1-2H3.
What are the key properties of 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol?
3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol has a molecular weight of 199.29 g/mol, XLogP of 1.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)-9-methyl-9-azabicyclo[3.3.1]nonan-3-ol is sourced from PubChem (CID 171953073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).