[5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol

C14H28N2O — CID 82243703

IUPAC[5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol
SMILESCC1CCCC(N2CC(C)(C)NCC2CO)C1
InChIInChI=1S/C14H28N2O/c1-11-5-4-6-12(7-11)16-10-14(2,3)15-8-13(16)9-17/h11-13,15,17H,4-10H2,1-3H3
InChIKeyLMGBJQZETZIFPA-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.61
Rot. Bonds2

About [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol

[5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol (PubChem CID 82243703) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol.

Molecular Properties

Compound Name[5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol
PubChem CID82243703
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name[5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol
SMILESCC1CCCC(N2CC(C)(C)NCC2CO)C1
InChIInChI=1S/C14H28N2O/c1-11-5-4-6-12(7-11)16-10-14(2,3)15-8-13(16)9-17/h11-13,15,17H,4-10H2,1-3H3
InChIKeyLMGBJQZETZIFPA-UHFFFAOYSA-N
XLogP1.61
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,5,5-triethyl-1-(3-methylcyclohexyl)piperazine
CID 64935770
2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine
CID 64932642
1-cycloheptyl-5,5-dimethyl-2-(2-methylpropyl)piperazine
CID 82936683
1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine
CID 64941054
2-ethyl-5,5-dimethyl-1-(3-methylsulfanylcyclopentyl)piperazine
CID 114122859
5,5-diethyl-1-(3-methylcyclohexyl)-2-propan-2-ylpiperazine
CID 64934232
(5,5-dimethyl-1-propylpiperazin-2-yl)methanol
CID 82241015
2-ethyl-5,5-dimethyl-1-(1-methylpiperidin-4-yl)piperazine
CID 64933663
2,5-diethyl-1-(3-methylcyclohexyl)piperazine
CID 64934041
1-(2,3-dimethylcyclohexyl)-2,5,5-trimethylpiperazine
CID 64932055
1-(3,5-dimethylcyclohexyl)-2,5,5-triethylpiperazine
CID 64940903
5-cyclopropyl-2,5-dimethyl-1-(3-methylcyclopentyl)piperazine
CID 114551135

Frequently Asked Questions

What is the IUPAC name of [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol?
The IUPAC name of [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol (CID 82243703) is [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol.
What is the SMILES notation for [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol?
The canonical SMILES for [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol is CC1CCCC(N2CC(C)(C)NCC2CO)C1.
What is the InChIKey of [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol?
The InChIKey is LMGBJQZETZIFPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-11-5-4-6-12(7-11)16-10-14(2,3)15-8-13(16)9-17/h11-13,15,17H,4-10H2,1-3H3.
What are the key properties of [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol?
[5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol is sourced from PubChem (CID 82243703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).