1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine

C16H32N2 — CID 64941054

IUPAC1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine
SMILESCCC1CNC(C)(C)CN1C1CCC(C)CC1C
InChIInChI=1S/C16H32N2/c1-6-14-10-17-16(4,5)11-18(14)15-8-7-12(2)9-13(15)3/h12-15,17H,6-11H2,1-5H3
InChIKeyVWNDEVCSKMGFHD-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.27
Rot. Bonds2

About 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine

1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine (PubChem CID 64941054) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine.

Molecular Properties

Compound Name1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine
PubChem CID64941054
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine
SMILESCCC1CNC(C)(C)CN1C1CCC(C)CC1C
InChIInChI=1S/C16H32N2/c1-6-14-10-17-16(4,5)11-18(14)15-8-7-12(2)9-13(15)3/h12-15,17H,6-11H2,1-5H3
InChIKeyVWNDEVCSKMGFHD-UHFFFAOYSA-N
XLogP3.27
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dimethylcyclopentyl)-2-ethyl-5,5-dimethylpiperazine
CID 64940916
2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine
CID 64932642
1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine
CID 64939537
1-(2,3-dimethylcyclopentyl)-2,5-diethyl-5-methylpiperazine
CID 64939777
2-ethyl-5,5-dimethyl-1-(1-methylpiperidin-4-yl)piperazine
CID 64933663
2-ethyl-5,5-dimethyl-1-(3-methylsulfanylcyclopentyl)piperazine
CID 114122859
1-(2,3-dimethylcyclopentyl)-2,5,5-triethylpiperazine
CID 64941490
[5,5-dimethyl-1-(3-methylcyclohexyl)piperazin-2-yl]methanol
CID 82243703
5-cyclopropyl-1-(2,3-dimethylcyclohexyl)-2-ethyl-5-methylpiperazine
CID 64931862
2,5,5-triethyl-1-(3-ethyl-2-methylcyclopentyl)piperazine
CID 64941493
2,5,5-triethyl-1-(3-methylcyclohexyl)piperazine
CID 64935770
2-ethyl-5,5-dimethyl-1-[(2-methylcyclohexyl)methyl]piperazine
CID 64945745

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine?
The IUPAC name of 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine (CID 64941054) is 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine.
What is the SMILES notation for 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine?
The canonical SMILES for 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine is CCC1CNC(C)(C)CN1C1CCC(C)CC1C.
What is the InChIKey of 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine?
The InChIKey is VWNDEVCSKMGFHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-6-14-10-17-16(4,5)11-18(14)15-8-7-12(2)9-13(15)3/h12-15,17H,6-11H2,1-5H3.
What are the key properties of 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine?
1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine is sourced from PubChem (CID 64941054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).