9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane

C16H32N2O — CID 106458879

IUPAC9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane
SMILESCC(C)COCCN1CC2(CCCC2)NCCC1C
InChIInChI=1S/C16H32N2O/c1-14(2)12-19-11-10-18-13-16(7-4-5-8-16)17-9-6-15(18)3/h14-15,17H,4-13H2,1-3H3
InChIKeySYXOSZUGIZDHTQ-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.66
Rot. Bonds5

About 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane

9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane (PubChem CID 106458879) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane.

Molecular Properties

Compound Name9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane
PubChem CID106458879
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane
SMILESCC(C)COCCN1CC2(CCCC2)NCCC1C
InChIInChI=1S/C16H32N2O/c1-14(2)12-19-11-10-18-13-16(7-4-5-8-16)17-9-6-15(18)3/h14-15,17H,4-13H2,1-3H3
InChIKeySYXOSZUGIZDHTQ-UHFFFAOYSA-N
XLogP2.66
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

10-(3-ethoxypropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 65178467
10-methyl-11-propyl-7,11-diazaspiro[5.6]dodecane
CID 64870179
9-methyl-10-(2-propan-2-ylsulfonylethyl)-6,10-diazaspiro[4.6]undecane
CID 106733400
10-(3-fluoropropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 81113015
10-(2-ethylsulfonylethyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 106733398
11-(2,2-difluoroethyl)-10-methyl-7,11-diazaspiro[5.6]dodecane
CID 64871559
10-(3-ethylsulfanylpropyl)-9-methyl-6,10-diazaspiro[4.6]undecane
CID 113474602
10-methyl-11-[2-(trifluoromethylsulfanyl)ethyl]-7,11-diazaspiro[5.6]dodecane
CID 116627590
9-methyl-10-[2-(oxolan-2-yl)ethyl]-6,10-diazaspiro[4.6]undecane
CID 65170391
10-methyl-11-(3-methylsulfonylpropyl)-7,11-diazaspiro[5.6]dodecane
CID 64869383
9-methyl-10-(3-methylbut-2-enyl)-6,10-diazaspiro[4.6]undecane
CID 114014155
10-methyl-11-(2,2,2-trifluoroethyl)-7,11-diazaspiro[5.6]dodecane
CID 64871366

Frequently Asked Questions

What is the IUPAC name of 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane?
The IUPAC name of 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane (CID 106458879) is 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane.
What is the SMILES notation for 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane?
The canonical SMILES for 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane is CC(C)COCCN1CC2(CCCC2)NCCC1C.
What is the InChIKey of 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane?
The InChIKey is SYXOSZUGIZDHTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-14(2)12-19-11-10-18-13-16(7-4-5-8-16)17-9-6-15(18)3/h14-15,17H,4-13H2,1-3H3.
What are the key properties of 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane?
9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane has a molecular weight of 268.44 g/mol, XLogP of 2.66, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-methyl-10-[2-(2-methylpropoxy)ethyl]-6,10-diazaspiro[4.6]undecane is sourced from PubChem (CID 106458879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).