3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane

C12H24N2 — CID 64883094

IUPAC3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
SMILESCCC1(C)CNC2(CCCCC2)CN1
InChIInChI=1S/C12H24N2/c1-3-11(2)9-14-12(10-13-11)7-5-4-6-8-12/h13-14H,3-10H2,1-2H3
InChIKeyWEXBOGLEGWSLEN-UHFFFAOYSA-N
MW196.34 g/mol
LogP2.05
Rot. Bonds1

About 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane

3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane (PubChem CID 64883094) has the molecular formula C12H24N2 and a molecular weight of 196.34 g/mol. Its IUPAC name is 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
PubChem CID64883094
Molecular FormulaC12H24N2
Molecular Weight196.34 g/mol
Exact Mass196.19
IUPAC Name3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
SMILESCCC1(C)CNC2(CCCCC2)CN1
InChIInChI=1S/C12H24N2/c1-3-11(2)9-14-12(10-13-11)7-5-4-6-8-12/h13-14H,3-10H2,1-2H3
InChIKeyWEXBOGLEGWSLEN-UHFFFAOYSA-N
XLogP2.05
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.34
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-azaspiro[2.6]nonane;propane
CID 171101466
8,8-dimethyl-6,9-diazaspiro[4.5]decane
CID 64884642
8-ethyl-6,8-dimethyl-6,9-diazaspiro[4.5]decane
CID 64875613
1,8-diazaspiro[3.5]nonane;propane
CID 123647748
9-cyclohexyl-8-ethyl-8-methyl-6,9-diazaspiro[4.5]decane
CID 82937208
4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
CID 82937209
4-(2-ethoxyethyl)-3,3-dimethyl-1,4-diazaspiro[5.5]undecane
CID 64878399
2,2-dimethylazocane
CID 123664425
3,3-diethyl-4-(2-methylsulfonylethyl)-1,4-diazaspiro[5.5]undecane
CID 64878214
8-ethyl-9-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 80697005
1,4-diazaspiro[5.6]dodecane
CID 51346047
8-methyl-8-propan-2-yl-6,10-diazaspiro[4.6]undecane
CID 167294014

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane (CID 64883094) is 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane is CCC1(C)CNC2(CCCCC2)CN1.
What is the InChIKey of 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane?
The InChIKey is WEXBOGLEGWSLEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2/c1-3-11(2)9-14-12(10-13-11)7-5-4-6-8-12/h13-14H,3-10H2,1-2H3.
What are the key properties of 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane?
3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane has a molecular weight of 196.34 g/mol, XLogP of 2.05, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 64883094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).