N-ethyl-6-oxaspiro[3.5]nonan-9-amine

C10H19NO — CID 166684997

IUPACN-ethyl-6-oxaspiro[3.5]nonan-9-amine
SMILESCCNC1CCOCC12CCC2
InChIInChI=1S/C10H19NO/c1-2-11-9-4-7-12-8-10(9)5-3-6-10/h9,11H,2-8H2,1H3
InChIKeyRJTSTKPQKNOVPL-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.56
Rot. Bonds2

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

N-ethyl-6-oxaspiro[3.5]nonan-9-amine (PubChem CID 166684997) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is N-ethyl-6-oxaspiro[3.5]nonan-9-amine.

Molecular Properties

Compound NameN-ethyl-6-oxaspiro[3.5]nonan-9-amine
PubChem CID166684997
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC NameN-ethyl-6-oxaspiro[3.5]nonan-9-amine
SMILESCCNC1CCOCC12CCC2
InChIInChI=1S/C10H19NO/c1-2-11-9-4-7-12-8-10(9)5-3-6-10/h9,11H,2-8H2,1H3
InChIKeyRJTSTKPQKNOVPL-UHFFFAOYSA-N
XLogP1.56
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-oxaspiro[3.5]nonan-9-amine?
The IUPAC name of N-ethyl-6-oxaspiro[3.5]nonan-9-amine (CID 166684997) is N-ethyl-6-oxaspiro[3.5]nonan-9-amine.
What is the SMILES notation for N-ethyl-6-oxaspiro[3.5]nonan-9-amine?
The canonical SMILES for N-ethyl-6-oxaspiro[3.5]nonan-9-amine is CCNC1CCOCC12CCC2.
What is the InChIKey of N-ethyl-6-oxaspiro[3.5]nonan-9-amine?
The InChIKey is RJTSTKPQKNOVPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c1-2-11-9-4-7-12-8-10(9)5-3-6-10/h9,11H,2-8H2,1H3.
What are the key properties of N-ethyl-6-oxaspiro[3.5]nonan-9-amine?
N-ethyl-6-oxaspiro[3.5]nonan-9-amine has a molecular weight of 169.27 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-oxaspiro[3.5]nonan-9-amine is sourced from PubChem (CID 166684997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).