1-oxaspiro[4.5]decan-8-amine

C9H17NO — CID 67070405

IUPAC1-oxaspiro[4.5]decan-8-amine
SMILESNC1CCC2(CCCO2)CC1
InChIInChI=1S/C9H17NO/c10-8-2-5-9(6-3-8)4-1-7-11-9/h8H,1-7,10H2
InChIKeySYNAWIBYSNHDPC-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.44
Rot. Bonds

About 1-oxaspiro[4.5]decan-8-amine

1-oxaspiro[4.5]decan-8-amine (PubChem CID 67070405) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-oxaspiro[4.5]decan-8-amine.

Molecular Properties

Compound Name1-oxaspiro[4.5]decan-8-amine
PubChem CID67070405
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-oxaspiro[4.5]decan-8-amine
SMILESNC1CCC2(CCCO2)CC1
InChIInChI=1S/C9H17NO/c10-8-2-5-9(6-3-8)4-1-7-11-9/h8H,1-7,10H2
InChIKeySYNAWIBYSNHDPC-UHFFFAOYSA-N
XLogP1.44
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-oxaspiro[4.5]decan-8-amine?
The IUPAC name of 1-oxaspiro[4.5]decan-8-amine (CID 67070405) is 1-oxaspiro[4.5]decan-8-amine.
What is the SMILES notation for 1-oxaspiro[4.5]decan-8-amine?
The canonical SMILES for 1-oxaspiro[4.5]decan-8-amine is NC1CCC2(CCCO2)CC1.
What is the InChIKey of 1-oxaspiro[4.5]decan-8-amine?
The InChIKey is SYNAWIBYSNHDPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c10-8-2-5-9(6-3-8)4-1-7-11-9/h8H,1-7,10H2.
What are the key properties of 1-oxaspiro[4.5]decan-8-amine?
1-oxaspiro[4.5]decan-8-amine has a molecular weight of 155.24 g/mol, XLogP of 1.44, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-oxaspiro[4.5]decan-8-amine is sourced from PubChem (CID 67070405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).