5-methoxy-5-methylazonane

C10H21NO — CID 137425996

IUPAC5-methoxy-5-methylazonane
SMILESCOC1(C)CCCCNCCC1
InChIInChI=1S/C10H21NO/c1-10(12-2)6-3-4-8-11-9-5-7-10/h11H,3-9H2,1-2H3
InChIKeyOPRBBBHXYGJIQT-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.95
Rot. Bonds1

About 5-methoxy-5-methylazonane

5-methoxy-5-methylazonane (PubChem CID 137425996) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 5-methoxy-5-methylazonane.

Molecular Properties

Compound Name5-methoxy-5-methylazonane
PubChem CID137425996
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name5-methoxy-5-methylazonane
SMILESCOC1(C)CCCCNCCC1
InChIInChI=1S/C10H21NO/c1-10(12-2)6-3-4-8-11-9-5-7-10/h11H,3-9H2,1-2H3
InChIKeyOPRBBBHXYGJIQT-UHFFFAOYSA-N
XLogP1.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-5-methylazonane?
The IUPAC name of 5-methoxy-5-methylazonane (CID 137425996) is 5-methoxy-5-methylazonane.
What is the SMILES notation for 5-methoxy-5-methylazonane?
The canonical SMILES for 5-methoxy-5-methylazonane is COC1(C)CCCCNCCC1.
What is the InChIKey of 5-methoxy-5-methylazonane?
The InChIKey is OPRBBBHXYGJIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-10(12-2)6-3-4-8-11-9-5-7-10/h11H,3-9H2,1-2H3.
What are the key properties of 5-methoxy-5-methylazonane?
5-methoxy-5-methylazonane has a molecular weight of 171.28 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-5-methylazonane is sourced from PubChem (CID 137425996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).