9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)

C8H13N2ORb — CID 59793757

IUPAC9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)
SMILESCN1C2C[N-]CC1CC(=O)C2.[Rb+]
InChIInChI=1S/C8H13N2O.Rb/c1-10-6-2-8(11)3-7(10)5-9-4-6;/h6-7H,2-5H2,1H3;/q-1;+1
InChIKeyPZZRZEMKEKLLKR-UHFFFAOYSA-N
MW238.67 g/mol
LogP-2.59
Rot. Bonds

About 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)

9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+) (PubChem CID 59793757) has the molecular formula C8H13N2ORb and a molecular weight of 238.67 g/mol. Its IUPAC name is 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+).

Molecular Properties

Compound Name9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)
PubChem CID59793757
Molecular FormulaC8H13N2ORb
Molecular Weight238.67 g/mol
Exact Mass238.01
IUPAC Name9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)
SMILESCN1C2C[N-]CC1CC(=O)C2.[Rb+]
InChIInChI=1S/C8H13N2O.Rb/c1-10-6-2-8(11)3-7(10)5-9-4-6;/h6-7H,2-5H2,1H3;/q-1;+1
InChIKeyPZZRZEMKEKLLKR-UHFFFAOYSA-N
XLogP-2.59
TPSA34.41 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.67
LogP ≤ 5-2.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)?
The IUPAC name of 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+) (CID 59793757) is 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+).
What is the SMILES notation for 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)?
The canonical SMILES for 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+) is CN1C2C[N-]CC1CC(=O)C2.[Rb+].
What is the InChIKey of 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)?
The InChIKey is PZZRZEMKEKLLKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N2O.Rb/c1-10-6-2-8(11)3-7(10)5-9-4-6;/h6-7H,2-5H2,1H3;/q-1;+1.
What are the key properties of 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+)?
9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+) has a molecular weight of 238.67 g/mol, XLogP of -2.59, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-9-aza-3-azanidabicyclo[3.3.1]nonan-7-one;rubidium(1+) is sourced from PubChem (CID 59793757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).