6-oxaspiro[3.5]nonan-9-amine

C8H15NO — CID 83904918

IUPAC6-oxaspiro[3.5]nonan-9-amine
SMILESNC1CCOCC12CCC2
InChIInChI=1S/C8H15NO/c9-7-2-5-10-6-8(7)3-1-4-8/h7H,1-6,9H2
InChIKeyOKKSVCPRNITCFK-UHFFFAOYSA-N
MW141.21 g/mol
LogP0.90
Rot. Bonds

About 6-oxaspiro[3.5]nonan-9-amine

6-oxaspiro[3.5]nonan-9-amine (PubChem CID 83904918) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 6-oxaspiro[3.5]nonan-9-amine.

Molecular Properties

Compound Name6-oxaspiro[3.5]nonan-9-amine
PubChem CID83904918
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name6-oxaspiro[3.5]nonan-9-amine
SMILESNC1CCOCC12CCC2
InChIInChI=1S/C8H15NO/c9-7-2-5-10-6-8(7)3-1-4-8/h7H,1-6,9H2
InChIKeyOKKSVCPRNITCFK-UHFFFAOYSA-N
XLogP0.90
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-oxaspiro[3.5]nonan-9-amine?
The IUPAC name of 6-oxaspiro[3.5]nonan-9-amine (CID 83904918) is 6-oxaspiro[3.5]nonan-9-amine.
What is the SMILES notation for 6-oxaspiro[3.5]nonan-9-amine?
The canonical SMILES for 6-oxaspiro[3.5]nonan-9-amine is NC1CCOCC12CCC2.
What is the InChIKey of 6-oxaspiro[3.5]nonan-9-amine?
The InChIKey is OKKSVCPRNITCFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c9-7-2-5-10-6-8(7)3-1-4-8/h7H,1-6,9H2.
What are the key properties of 6-oxaspiro[3.5]nonan-9-amine?
6-oxaspiro[3.5]nonan-9-amine has a molecular weight of 141.21 g/mol, XLogP of 0.90, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxaspiro[3.5]nonan-9-amine is sourced from PubChem (CID 83904918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).