7-methyl-1-azabicyclo[3.3.1]nonan-3-ol

C9H17NO — CID 18986088

IUPAC7-methyl-1-azabicyclo[3.3.1]nonan-3-ol
SMILESCC1CC2CC(O)CN(C1)C2
InChIInChI=1S/C9H17NO/c1-7-2-8-3-9(11)6-10(4-7)5-8/h7-9,11H,2-6H2,1H3
InChIKeyPEDHPWIZTMOVIS-UHFFFAOYSA-N
MW155.24 g/mol
LogP0.71
Rot. Bonds

About 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol

7-methyl-1-azabicyclo[3.3.1]nonan-3-ol (PubChem CID 18986088) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol.

Molecular Properties

Compound Name7-methyl-1-azabicyclo[3.3.1]nonan-3-ol
PubChem CID18986088
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name7-methyl-1-azabicyclo[3.3.1]nonan-3-ol
SMILESCC1CC2CC(O)CN(C1)C2
InChIInChI=1S/C9H17NO/c1-7-2-8-3-9(11)6-10(4-7)5-8/h7-9,11H,2-6H2,1H3
InChIKeyPEDHPWIZTMOVIS-UHFFFAOYSA-N
XLogP0.71
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol?
The IUPAC name of 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol (CID 18986088) is 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol.
What is the SMILES notation for 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol?
The canonical SMILES for 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol is CC1CC2CC(O)CN(C1)C2.
What is the InChIKey of 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol?
The InChIKey is PEDHPWIZTMOVIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-7-2-8-3-9(11)6-10(4-7)5-8/h7-9,11H,2-6H2,1H3.
What are the key properties of 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol?
7-methyl-1-azabicyclo[3.3.1]nonan-3-ol has a molecular weight of 155.24 g/mol, XLogP of 0.71, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-1-azabicyclo[3.3.1]nonan-3-ol is sourced from PubChem (CID 18986088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).