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

C11H21NO — CID 156812980

IUPACN-propyl-6-oxaspiro[3.5]nonan-9-amine
SMILESCCCNC1CCOCC12CCC2
InChIInChI=1S/C11H21NO/c1-2-7-12-10-4-8-13-9-11(10)5-3-6-11/h10,12H,2-9H2,1H3
InChIKeyOOIJXBWRXHJKES-UHFFFAOYSA-N
MW183.29 g/mol
LogP1.95
Rot. Bonds3

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

N-propyl-6-oxaspiro[3.5]nonan-9-amine (PubChem CID 156812980) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is N-propyl-6-oxaspiro[3.5]nonan-9-amine.

Molecular Properties

Compound NameN-propyl-6-oxaspiro[3.5]nonan-9-amine
PubChem CID156812980
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC NameN-propyl-6-oxaspiro[3.5]nonan-9-amine
SMILESCCCNC1CCOCC12CCC2
InChIInChI=1S/C11H21NO/c1-2-7-12-10-4-8-13-9-11(10)5-3-6-11/h10,12H,2-9H2,1H3
InChIKeyOOIJXBWRXHJKES-UHFFFAOYSA-N
XLogP1.95
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-propyl-6-oxaspiro[3.5]nonan-9-amine?
The IUPAC name of N-propyl-6-oxaspiro[3.5]nonan-9-amine (CID 156812980) is N-propyl-6-oxaspiro[3.5]nonan-9-amine.
What is the SMILES notation for N-propyl-6-oxaspiro[3.5]nonan-9-amine?
The canonical SMILES for N-propyl-6-oxaspiro[3.5]nonan-9-amine is CCCNC1CCOCC12CCC2.
What is the InChIKey of N-propyl-6-oxaspiro[3.5]nonan-9-amine?
The InChIKey is OOIJXBWRXHJKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-2-7-12-10-4-8-13-9-11(10)5-3-6-11/h10,12H,2-9H2,1H3.
What are the key properties of N-propyl-6-oxaspiro[3.5]nonan-9-amine?
N-propyl-6-oxaspiro[3.5]nonan-9-amine has a molecular weight of 183.29 g/mol, XLogP of 1.95, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-6-oxaspiro[3.5]nonan-9-amine is sourced from PubChem (CID 156812980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).