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

C18H34N2 — CID 82937209

IUPAC4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
SMILESCCC1(C)CNC2(CCCCC2)CN1C1CCCCC1
InChIInChI=1S/C18H34N2/c1-3-17(2)14-19-18(12-8-5-9-13-18)15-20(17)16-10-6-4-7-11-16/h16,19H,3-15H2,1-2H3
InChIKeyIVOKTNYOEUSLFW-UHFFFAOYSA-N
MW278.48 g/mol
LogP4.10
Rot. Bonds2

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

4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane (PubChem CID 82937209) has the molecular formula C18H34N2 and a molecular weight of 278.48 g/mol. Its IUPAC name is 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
PubChem CID82937209
Molecular FormulaC18H34N2
Molecular Weight278.48 g/mol
Exact Mass278.27
IUPAC Name4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane
SMILESCCC1(C)CNC2(CCCCC2)CN1C1CCCCC1
InChIInChI=1S/C18H34N2/c1-3-17(2)14-19-18(12-8-5-9-13-18)15-20(17)16-10-6-4-7-11-16/h16,19H,3-15H2,1-2H3
InChIKeyIVOKTNYOEUSLFW-UHFFFAOYSA-N
XLogP4.10
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.48
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

9-cyclohexyl-8-ethyl-8-methyl-6,9-diazaspiro[4.5]decane
CID 82937208
4-cyclohexyl-3,3-dimethyl-1,4-diazaspiro[5.5]undecane
CID 82937035
1-cyclopentyl-2,5-diethyl-2,5-dimethylpiperazine
CID 82936178
1-cycloheptyl-5-cyclopropyl-2-ethyl-2,5-dimethylpiperazine
CID 82936095
8-ethyl-9-(2-fluoroethyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 80697005
1-cyclopentyl-3,3-diethyl-1,4-diazaspiro[5.5]undecane
CID 82937126
3-ethyl-3-methyl-4-[(2-methyltetrazol-5-yl)methyl]-1,4-diazaspiro[5.5]undecane
CID 107055949
3-ethyl-3-methyl-4-[2-[(2-methylpropan-2-yl)oxy]ethyl]-1,4-diazaspiro[5.5]undecane
CID 115943654
8-ethyl-9-(2-methoxypropyl)-8-methyl-6,9-diazaspiro[4.5]decane
CID 113383044
8-ethyl-8-methyl-9-(2-propoxyethyl)-6,9-diazaspiro[4.5]decane
CID 106458732
1-azaspiro[2.6]nonane;propane
CID 171101466
8-ethyl-8-methyl-9-[2-(trifluoromethylsulfanyl)ethyl]-6,9-diazaspiro[4.5]decane
CID 116627516

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane (CID 82937209) is 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane is CCC1(C)CNC2(CCCCC2)CN1C1CCCCC1.
What is the InChIKey of 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane?
The InChIKey is IVOKTNYOEUSLFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2/c1-3-17(2)14-19-18(12-8-5-9-13-18)15-20(17)16-10-6-4-7-11-16/h16,19H,3-15H2,1-2H3.
What are the key properties of 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane?
4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane has a molecular weight of 278.48 g/mol, XLogP of 4.10, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-3-ethyl-3-methyl-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 82937209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).