N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine

C13H23NO2 — CID 83236499

IUPACN-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine
SMILESC1CCC(ONC2CCOC3(CCC3)C2)C1
InChIInChI=1S/C13H23NO2/c1-2-5-12(4-1)16-14-11-6-9-15-13(10-11)7-3-8-13/h11-12,14H,1-10H2
InChIKeyYBUKONKJSOQNLK-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.55
Rot. Bonds3

About N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine

N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine (PubChem CID 83236499) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine.

Molecular Properties

Compound NameN-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine
PubChem CID83236499
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC NameN-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine
SMILESC1CCC(ONC2CCOC3(CCC3)C2)C1
InChIInChI=1S/C13H23NO2/c1-2-5-12(4-1)16-14-11-6-9-15-13(10-11)7-3-8-13/h11-12,14H,1-10H2
InChIKeyYBUKONKJSOQNLK-UHFFFAOYSA-N
XLogP2.55
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyloxy-2,6-dioxaspiro[4.5]decan-9-amine
CID 83229706
N-(2-cyclopentyloxyethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79903516
N-cyclohexyl-1-oxaspiro[5.5]undecan-4-amine
CID 79898516
N-(2-methylpropyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79898518
N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine
CID 79903838
N-(1-methylcyclopentyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895072
N-(oxan-4-ylmethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79903433
N-cyclobutyl-1-oxaspiro[5.5]undecan-4-amine
CID 79895616
5-oxaspiro[3.5]nonan-8-ylurea
CID 131086736
N'-(5-oxaspiro[3.5]nonan-8-yl)ethane-1,2-diamine
CID 79895111
N-(oxan-3-yl)-5-oxaspiro[3.5]nonan-8-amine
CID 79903513
N-[(1-methylcyclopropyl)methyl]-5-oxaspiro[3.5]nonan-8-amine
CID 107166629

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine?
The IUPAC name of N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine (CID 83236499) is N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine.
What is the SMILES notation for N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine?
The canonical SMILES for N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine is C1CCC(ONC2CCOC3(CCC3)C2)C1.
What is the InChIKey of N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine?
The InChIKey is YBUKONKJSOQNLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-2-5-12(4-1)16-14-11-6-9-15-13(10-11)7-3-8-13/h11-12,14H,1-10H2.
What are the key properties of N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine?
N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine has a molecular weight of 225.33 g/mol, XLogP of 2.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine is sourced from PubChem (CID 83236499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).