7-oxaspiro[3.5]nonan-8-ylmethanamine

C9H17NO — CID 154814522

IUPAC7-oxaspiro[3.5]nonan-8-ylmethanamine
SMILESNCC1CC2(CCC2)CCO1
InChIInChI=1S/C9H17NO/c10-7-8-6-9(2-1-3-9)4-5-11-8/h8H,1-7,10H2
InChIKeyCNCNJIRLJVTYCG-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.29
Rot. Bonds1

About 7-oxaspiro[3.5]nonan-8-ylmethanamine

7-oxaspiro[3.5]nonan-8-ylmethanamine (PubChem CID 154814522) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 7-oxaspiro[3.5]nonan-8-ylmethanamine.

Molecular Properties

Compound Name7-oxaspiro[3.5]nonan-8-ylmethanamine
PubChem CID154814522
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name7-oxaspiro[3.5]nonan-8-ylmethanamine
SMILESNCC1CC2(CCC2)CCO1
InChIInChI=1S/C9H17NO/c10-7-8-6-9(2-1-3-9)4-5-11-8/h8H,1-7,10H2
InChIKeyCNCNJIRLJVTYCG-UHFFFAOYSA-N
XLogP1.29
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-oxaspiro[3.5]nonan-8-ylmethanamine?
The IUPAC name of 7-oxaspiro[3.5]nonan-8-ylmethanamine (CID 154814522) is 7-oxaspiro[3.5]nonan-8-ylmethanamine.
What is the SMILES notation for 7-oxaspiro[3.5]nonan-8-ylmethanamine?
The canonical SMILES for 7-oxaspiro[3.5]nonan-8-ylmethanamine is NCC1CC2(CCC2)CCO1.
What is the InChIKey of 7-oxaspiro[3.5]nonan-8-ylmethanamine?
The InChIKey is CNCNJIRLJVTYCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c10-7-8-6-9(2-1-3-9)4-5-11-8/h8H,1-7,10H2.
What are the key properties of 7-oxaspiro[3.5]nonan-8-ylmethanamine?
7-oxaspiro[3.5]nonan-8-ylmethanamine has a molecular weight of 155.24 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-oxaspiro[3.5]nonan-8-ylmethanamine is sourced from PubChem (CID 154814522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).