1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane

C17H32N2 — CID 79846903

IUPAC1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane
SMILESCC1(C)CCCCC1N1CCNCC12CCCCC2
InChIInChI=1S/C17H32N2/c1-16(2)9-7-4-8-15(16)19-13-12-18-14-17(19)10-5-3-6-11-17/h15,18H,3-14H2,1-2H3
InChIKeyMIOABTZMZWYLQI-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.56
Rot. Bonds1

About 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane

1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane (PubChem CID 79846903) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane.

Molecular Properties

Compound Name1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane
PubChem CID79846903
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane
SMILESCC1(C)CCCCC1N1CCNCC12CCCCC2
InChIInChI=1S/C17H32N2/c1-16(2)9-7-4-8-15(16)19-13-12-18-14-17(19)10-5-3-6-11-17/h15,18H,3-14H2,1-2H3
InChIKeyMIOABTZMZWYLQI-UHFFFAOYSA-N
XLogP3.56
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,2-dimethylcyclopentyl)-2,2-dimethylpiperazine
CID 79862905
1-cycloheptyl-2,2-dimethylpiperazine
CID 65460692
1-(2,2-dimethylcyclohexyl)-6-methyl-1,4-diazepane
CID 79879039
1-methyl-1,4-diazaspiro[5.5]undecane
CID 20761876
6-(3-methoxycyclohexyl)-6,9-diazaspiro[4.5]decane
CID 64845611
(2S)-1-(2,2-dimethylcyclopentyl)-2-methylpiperazine
CID 130678144
(27S)-5,21,26,26-tetramethyl-1-azabicyclo[25.8.0]pentatriacontane
CID 155003765
1-cyclobutyl-2,2-dimethylpiperazine
CID 59454526
1-cyclohexyl-2,2-dimethyl-1,4-diazepane
CID 82241587
5-methyl-2,5-diazaspiro[3.41]pentatetracontane
CID 134587859
2,2-dimethyl-1-(1-oxaspiro[5.5]undecan-4-yl)piperazine
CID 79902972
2-(2,2-dimethylcyclohexyl)-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
CID 79929028

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane?
The IUPAC name of 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane (CID 79846903) is 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane.
What is the SMILES notation for 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane?
The canonical SMILES for 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane is CC1(C)CCCCC1N1CCNCC12CCCCC2.
What is the InChIKey of 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane?
The InChIKey is MIOABTZMZWYLQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2/c1-16(2)9-7-4-8-15(16)19-13-12-18-14-17(19)10-5-3-6-11-17/h15,18H,3-14H2,1-2H3.
What are the key properties of 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane?
1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane has a molecular weight of 264.46 g/mol, XLogP of 3.56, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylcyclohexyl)-1,4-diazaspiro[5.5]undecane is sourced from PubChem (CID 79846903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).