8-propyl-5-oxa-8-azaspiro[3.5]nonane

C10H19NO — CID 127705172

IUPAC8-propyl-5-oxa-8-azaspiro[3.5]nonane
SMILESCCCN1CCOC2(CCC2)C1
InChIInChI=1S/C10H19NO/c1-2-6-11-7-8-12-10(9-11)4-3-5-10/h2-9H2,1H3
InChIKeyZLKMKFJKPQGYPS-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.65
Rot. Bonds2

About 8-propyl-5-oxa-8-azaspiro[3.5]nonane

8-propyl-5-oxa-8-azaspiro[3.5]nonane (PubChem CID 127705172) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 8-propyl-5-oxa-8-azaspiro[3.5]nonane.

Molecular Properties

Compound Name8-propyl-5-oxa-8-azaspiro[3.5]nonane
PubChem CID127705172
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name8-propyl-5-oxa-8-azaspiro[3.5]nonane
SMILESCCCN1CCOC2(CCC2)C1
InChIInChI=1S/C10H19NO/c1-2-6-11-7-8-12-10(9-11)4-3-5-10/h2-9H2,1H3
InChIKeyZLKMKFJKPQGYPS-UHFFFAOYSA-N
XLogP1.65
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-propyl-5-oxa-8-azaspiro[3.5]nonane?
The IUPAC name of 8-propyl-5-oxa-8-azaspiro[3.5]nonane (CID 127705172) is 8-propyl-5-oxa-8-azaspiro[3.5]nonane.
What is the SMILES notation for 8-propyl-5-oxa-8-azaspiro[3.5]nonane?
The canonical SMILES for 8-propyl-5-oxa-8-azaspiro[3.5]nonane is CCCN1CCOC2(CCC2)C1.
What is the InChIKey of 8-propyl-5-oxa-8-azaspiro[3.5]nonane?
The InChIKey is ZLKMKFJKPQGYPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-6-11-7-8-12-10(9-11)4-3-5-10/h2-9H2,1H3.
What are the key properties of 8-propyl-5-oxa-8-azaspiro[3.5]nonane?
8-propyl-5-oxa-8-azaspiro[3.5]nonane has a molecular weight of 169.27 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propyl-5-oxa-8-azaspiro[3.5]nonane is sourced from PubChem (CID 127705172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).