2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane

C22H28N2O — CID 56716924

IUPAC2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane
SMILESc1ccc(COc2ccccc2CN2CCC3(CCNCC3)C2)cc1
InChIInChI=1S/C22H28N2O/c1-2-6-19(7-3-1)17-25-21-9-5-4-8-20(21)16-24-15-12-22(18-24)10-13-23-14-11-22/h1-9,23H,10-18H2
InChIKeyGMNPJGGZFHYEAN-UHFFFAOYSA-N
MW336.48 g/mol
LogP3.84
Rot. Bonds5

About 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane

2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane (PubChem CID 56716924) has the molecular formula C22H28N2O and a molecular weight of 336.48 g/mol. Its IUPAC name is 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane
PubChem CID56716924
Molecular FormulaC22H28N2O
Molecular Weight336.48 g/mol
Exact Mass336.22
IUPAC Name2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane
SMILESc1ccc(COc2ccccc2CN2CCC3(CCNCC3)C2)cc1
InChIInChI=1S/C22H28N2O/c1-2-6-19(7-3-1)17-25-21-9-5-4-8-20(21)16-24-15-12-22(18-24)10-13-23-14-11-22/h1-9,23H,10-18H2
InChIKeyGMNPJGGZFHYEAN-UHFFFAOYSA-N
XLogP3.84
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.48
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3,5-dimethoxy-4-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906722
2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane
CID 3233910
2-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906820
(5R)-2-benzyl-2,7-diazaspiro[4.4]nonane
CID 34178522
8-benzyl-3,8-diazaspiro[5.6]dodecane
CID 82665591
2-[(4-methoxynaphthalen-1-yl)methyl]-2,8-diazaspiro[4.5]decane
CID 120907099
2-(quinolin-8-ylmethyl)-2,8-diazaspiro[4.5]decane
CID 120907566
2-[(4-methoxynaphthalen-1-yl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120907098
2-[(2,3-dimethylphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906566
2-[[4-(pyridin-4-ylmethoxy)phenyl]methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120907233
2-benzyl-2,7-diazaspiro[4.4]nonane;methanamine
CID 142253116
2-[(3-chloro-2-fluorophenyl)methyl]-2,8-diazaspiro[4.5]decane
CID 120906452

Frequently Asked Questions

What is the IUPAC name of 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane (CID 56716924) is 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane is c1ccc(COc2ccccc2CN2CCC3(CCNCC3)C2)cc1.
What is the InChIKey of 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane?
The InChIKey is GMNPJGGZFHYEAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O/c1-2-6-19(7-3-1)17-25-21-9-5-4-8-20(21)16-24-15-12-22(18-24)10-13-23-14-11-22/h1-9,23H,10-18H2.
What are the key properties of 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane?
2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane has a molecular weight of 336.48 g/mol, XLogP of 3.84, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 56716924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).