9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane

C16H32N2O — CID 176630003

IUPAC9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane
SMILESCN1CCC2(CC1)CCN(CCOC(C)(C)C)CC2
InChIInChI=1S/C16H32N2O/c1-15(2,3)19-14-13-18-11-7-16(8-12-18)5-9-17(4)10-6-16/h5-14H2,1-4H3
InChIKeyMUBWCUAFUCFEJD-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.61
Rot. Bonds3

About 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane

9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane (PubChem CID 176630003) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane
PubChem CID176630003
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane
SMILESCN1CCC2(CC1)CCN(CCOC(C)(C)C)CC2
InChIInChI=1S/C16H32N2O/c1-15(2,3)19-14-13-18-11-7-16(8-12-18)5-9-17(4)10-6-16/h5-14H2,1-4H3
InChIKeyMUBWCUAFUCFEJD-UHFFFAOYSA-N
XLogP2.61
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-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

[4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-4-yl]methanamine
CID 107160540
4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine-4-carbonitrile
CID 103994003
7-[3-[(2-methylpropan-2-yl)oxy]propyl]-2-oxa-7-azaspiro[3.5]nonane
CID 176757500
4-methyl-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidine
CID 59691701
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-4-(2-propan-2-yloxyethyl)piperazine
CID 135217006
2-(2,2-dimethylpropoxy)-7-[3-[(2-methylpropan-2-yl)oxy]propyl]-7-azaspiro[3.5]nonane
CID 140899125
3-bromo-1-[2-[(2-methylpropan-2-yl)oxy]ethyl]pyrrolidine
CID 112591814
3-(1-fluoro-2-methylpropan-2-yl)-9-methyl-3,9-diazaspiro[5.5]undecane
CID 168838463
1-butan-2-yl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazine
CID 135279301
2-methyl-2-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propanenitrile
CID 112589445
1-[2-[(2-methylpropan-2-yl)oxy]ethyl]-4-piperidin-1-ylpiperidine
CID 56822093
2-methyl-3-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]propan-1-amine
CID 112588403

Frequently Asked Questions

What is the IUPAC name of 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane?
The IUPAC name of 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane (CID 176630003) is 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane.
What is the SMILES notation for 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane?
The canonical SMILES for 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane is CN1CCC2(CC1)CCN(CCOC(C)(C)C)CC2.
What is the InChIKey of 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane?
The InChIKey is MUBWCUAFUCFEJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-15(2,3)19-14-13-18-11-7-16(8-12-18)5-9-17(4)10-6-16/h5-14H2,1-4H3.
What are the key properties of 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane?
9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane has a molecular weight of 268.44 g/mol, XLogP of 2.61, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-3-[2-[(2-methylpropan-2-yl)oxy]ethyl]-3,9-diazaspiro[5.5]undecane is sourced from PubChem (CID 176630003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).