2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane

C17H26N2O — CID 3233910

IUPAC2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane
SMILESCOc1ccccc1CN1CCCC2(CCNCC2)C1
InChIInChI=1S/C17H26N2O/c1-20-16-6-3-2-5-15(16)13-19-12-4-7-17(14-19)8-10-18-11-9-17/h2-3,5-6,18H,4,7-14H2,1H3
InChIKeyVFMYJZQQNSMLLH-UHFFFAOYSA-N
MW274.41 g/mol
LogP2.66
Rot. Bonds3

About 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane

2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane (PubChem CID 3233910) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane
PubChem CID3233910
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane
SMILESCOc1ccccc1CN1CCCC2(CCNCC2)C1
InChIInChI=1S/C17H26N2O/c1-20-16-6-3-2-5-15(16)13-19-12-4-7-17(14-19)8-10-18-11-9-17/h2-3,5-6,18H,4,7-14H2,1H3
InChIKeyVFMYJZQQNSMLLH-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane 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

(5R)-7-[(2,3-dimethoxyphenyl)methyl]-2,7-diazaspiro[4.5]decane
CID 95729851
2-[(2,5-dimethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906879
2-[(4-methoxynaphthalen-1-yl)methyl]-2,8-diazaspiro[4.5]decane
CID 120907099
2-[(4-methoxynaphthalen-1-yl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120907098
2-(2,8-diazaspiro[5.5]undecan-2-ylmethyl)-6-methoxyphenol
CID 102849331
2-[(2-phenylmethoxyphenyl)methyl]-2,8-diazaspiro[4.5]decane
CID 56716924
1-[(5S)-2-[(2-methoxyphenyl)methyl]-2,7-diazaspiro[4.5]decan-7-yl]ethanone
CID 3233425
8-benzyl-3,8-diazaspiro[5.6]dodecane
CID 82665591
7-[(6-methoxy-1,3-benzodioxol-5-yl)methyl]-2,7-diazaspiro[4.5]decane
CID 56754640
1-[(2-methoxyphenyl)methyl]-3-propylpiperidine-3-carboxylic acid
CID 63140979
[4-[(2-methoxyphenyl)methyl]piperazin-1-yl]-(4-methoxypiperidin-4-yl)methanone
CID 119876180
[1-[(2-methoxyphenyl)methyl]-3-[(2-methylphenyl)methyl]piperidin-3-yl]methanol
CID 45213151

Frequently Asked Questions

What is the IUPAC name of 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane?
The IUPAC name of 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane (CID 3233910) is 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane?
The canonical SMILES for 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane is COc1ccccc1CN1CCCC2(CCNCC2)C1.
What is the InChIKey of 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane?
The InChIKey is VFMYJZQQNSMLLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-20-16-6-3-2-5-15(16)13-19-12-4-7-17(14-19)8-10-18-11-9-17/h2-3,5-6,18H,4,7-14H2,1H3.
What are the key properties of 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane?
2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane has a molecular weight of 274.41 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methoxyphenyl)methyl]-2,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 3233910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).