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

C15H21NO2 — CID 79903838

IUPACN-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine
SMILESc1ccc(CONC2CCOC3(CCC3)C2)cc1
InChIInChI=1S/C15H21NO2/c1-2-5-13(6-3-1)12-18-16-14-7-10-17-15(11-14)8-4-9-15/h1-3,5-6,14,16H,4,7-12H2
InChIKeyZIWOOLSZKLNVHL-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.81
Rot. Bonds4

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

N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine (PubChem CID 79903838) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine.

Molecular Properties

Compound NameN-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine
PubChem CID79903838
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine
SMILESc1ccc(CONC2CCOC3(CCC3)C2)cc1
InChIInChI=1S/C15H21NO2/c1-2-5-13(6-3-1)12-18-16-14-7-10-17-15(11-14)8-4-9-15/h1-3,5-6,14,16H,4,7-12H2
InChIKeyZIWOOLSZKLNVHL-UHFFFAOYSA-N
XLogP2.81
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(methoxymethyl)phenyl]-6-oxaspiro[4.5]decan-9-amine
CID 79895159
N-(2-phenylcyclopropyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895170
N-[(2-chlorophenyl)methyl]-5-oxaspiro[3.5]nonan-8-amine
CID 79897702
4-phenylmethoxy-1-oxa-9-azaspiro[5.5]undecane
CID 86820394
N-(2-phenoxyethyl)-1-oxaspiro[5.5]undecan-4-amine
CID 79899028
N-cyclopentyloxy-5-oxaspiro[3.5]nonan-8-amine
CID 83236499
(4R)-N-[(3-phenylmethoxyphenyl)methyl]-1,9-dioxaspiro[5.5]undecan-4-amine
CID 96577043
2-(6-oxaspiro[4.5]decan-9-yl)-2-(phenylmethoxycarbonylamino)acetic acid
CID 103739444
N-[(2-ethylphenyl)methyl]-5-oxaspiro[3.5]nonan-8-amine
CID 79903292
1-N,2-N-bis(phenylmethoxy)cyclohexane-1,2-diamine
CID 3839523
N-(2-pyridin-3-ylethyl)-5-oxaspiro[3.5]nonan-8-amine
CID 79895344
N-(2-phenylpropyl)-6-oxaspiro[4.5]decan-9-amine
CID 104591426

Frequently Asked Questions

What is the IUPAC name of N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine?
The IUPAC name of N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine (CID 79903838) is N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine.
What is the SMILES notation for N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine?
The canonical SMILES for N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine is c1ccc(CONC2CCOC3(CCC3)C2)cc1.
What is the InChIKey of N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine?
The InChIKey is ZIWOOLSZKLNVHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-2-5-13(6-3-1)12-18-16-14-7-10-17-15(11-14)8-4-9-15/h1-3,5-6,14,16H,4,7-12H2.
What are the key properties of N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine?
N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine has a molecular weight of 247.34 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenylmethoxy-5-oxaspiro[3.5]nonan-8-amine is sourced from PubChem (CID 79903838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).