2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine

C15H30N2 — CID 64932642

IUPAC2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine
SMILESCCC1CNC(C)(C)CN1C1CCC(C)CC1
InChIInChI=1S/C15H30N2/c1-5-13-10-16-15(3,4)11-17(13)14-8-6-12(2)7-9-14/h12-14,16H,5-11H2,1-4H3
InChIKeyOUWNBNROBQRLGC-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds2

About 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine

2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine (PubChem CID 64932642) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine.

Molecular Properties

Compound Name2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine
PubChem CID64932642
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine
SMILESCCC1CNC(C)(C)CN1C1CCC(C)CC1
InChIInChI=1S/C15H30N2/c1-5-13-10-16-15(3,4)11-17(13)14-8-6-12(2)7-9-14/h12-14,16H,5-11H2,1-4H3
InChIKeyOUWNBNROBQRLGC-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine?
The IUPAC name of 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine (CID 64932642) is 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine.
What is the SMILES notation for 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine?
The canonical SMILES for 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine is CCC1CNC(C)(C)CN1C1CCC(C)CC1.
What is the InChIKey of 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine?
The InChIKey is OUWNBNROBQRLGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-5-13-10-16-15(3,4)11-17(13)14-8-6-12(2)7-9-14/h12-14,16H,5-11H2,1-4H3.
What are the key properties of 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine?
2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine is sourced from PubChem (CID 64932642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).