6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane

C18H35NO — CID 21330384

IUPAC6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane
SMILESCCCCN1C(C)(CC)CC(OC)C(C)C12CCCC2
InChIInChI=1S/C18H35NO/c1-6-8-13-19-17(4,7-2)14-16(20-5)15(3)18(19)11-9-10-12-18/h15-16H,6-14H2,1-5H3
InChIKeyGHCGXLZGKDSYFS-UHFFFAOYSA-N
MW281.48 g/mol
LogP4.62
Rot. Bonds5

About 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane

6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane (PubChem CID 21330384) has the molecular formula C18H35NO and a molecular weight of 281.48 g/mol. Its IUPAC name is 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane.

Molecular Properties

Compound Name6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane
PubChem CID21330384
Molecular FormulaC18H35NO
Molecular Weight281.48 g/mol
Exact Mass281.27
IUPAC Name6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane
SMILESCCCCN1C(C)(CC)CC(OC)C(C)C12CCCC2
InChIInChI=1S/C18H35NO/c1-6-8-13-19-17(4,7-2)14-16(20-5)15(3)18(19)11-9-10-12-18/h15-16H,6-14H2,1-5H3
InChIKeyGHCGXLZGKDSYFS-UHFFFAOYSA-N
XLogP4.62
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.48
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane?
The IUPAC name of 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane (CID 21330384) is 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane.
What is the SMILES notation for 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane?
The canonical SMILES for 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane is CCCCN1C(C)(CC)CC(OC)C(C)C12CCCC2.
What is the InChIKey of 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane?
The InChIKey is GHCGXLZGKDSYFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35NO/c1-6-8-13-19-17(4,7-2)14-16(20-5)15(3)18(19)11-9-10-12-18/h15-16H,6-14H2,1-5H3.
What are the key properties of 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane?
6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane has a molecular weight of 281.48 g/mol, XLogP of 4.62, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-butyl-7-ethyl-9-methoxy-7,10-dimethyl-6-azaspiro[4.5]decane is sourced from PubChem (CID 21330384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).