7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane

C12H23NO — CID 167041007

IUPAC7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane
SMILESCOCCN1CCC2(CC1)CC(C)C2
InChIInChI=1S/C12H23NO/c1-11-9-12(10-11)3-5-13(6-4-12)7-8-14-2/h11H,3-10H2,1-2H3
InChIKeyQHIKHMBKMSYWLX-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.14
Rot. Bonds3

About 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane

7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane (PubChem CID 167041007) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane.

Molecular Properties

Compound Name7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane
PubChem CID167041007
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane
SMILESCOCCN1CCC2(CC1)CC(C)C2
InChIInChI=1S/C12H23NO/c1-11-9-12(10-11)3-5-13(6-4-12)7-8-14-2/h11H,3-10H2,1-2H3
InChIKeyQHIKHMBKMSYWLX-UHFFFAOYSA-N
XLogP2.14
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane?
The IUPAC name of 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane (CID 167041007) is 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane.
What is the SMILES notation for 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane?
The canonical SMILES for 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane is COCCN1CCC2(CC1)CC(C)C2.
What is the InChIKey of 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane?
The InChIKey is QHIKHMBKMSYWLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-11-9-12(10-11)3-5-13(6-4-12)7-8-14-2/h11H,3-10H2,1-2H3.
What are the key properties of 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane?
7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane has a molecular weight of 197.32 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2-methoxyethyl)-2-methyl-7-azaspiro[3.5]nonane is sourced from PubChem (CID 167041007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).