1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine

C15H28N2 — CID 64939537

IUPAC1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine
SMILESCCC1CNC(C)(C)CN1C1CC2CCC1C2
InChIInChI=1S/C15H28N2/c1-4-13-9-16-15(2,3)10-17(13)14-8-11-5-6-12(14)7-11/h11-14,16H,4-10H2,1-3H3
InChIKeyJBKVCQSWOATYCE-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.64
Rot. Bonds2

About 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine

1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine (PubChem CID 64939537) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine.

Molecular Properties

Compound Name1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine
PubChem CID64939537
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC Name1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine
SMILESCCC1CNC(C)(C)CN1C1CC2CCC1C2
InChIInChI=1S/C15H28N2/c1-4-13-9-16-15(2,3)10-17(13)14-8-11-5-6-12(14)7-11/h11-14,16H,4-10H2,1-3H3
InChIKeyJBKVCQSWOATYCE-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bicyclo[2.2.1]heptanyl)-2-cyclopropyl-5,5-dimethylpiperazine
CID 114246764
1-(2,4-dimethylcyclohexyl)-2-ethyl-5,5-dimethylpiperazine
CID 64941054
1-(2,3-dimethylcyclopentyl)-2-ethyl-5,5-dimethylpiperazine
CID 64940916
2-ethyl-5,5-dimethyl-1-(4-methylcyclohexyl)piperazine
CID 64932642
2-ethyl-5,5-dimethyl-1-(1-methylpiperidin-4-yl)piperazine
CID 64933663
2-ethyl-5,5-dimethyl-1-(3-methylsulfanylcyclopentyl)piperazine
CID 114122859
5-cyclopropyl-1-(2,3-dimethylcyclohexyl)-2-ethyl-5-methylpiperazine
CID 64931862
3-(2,5-diethyl-5-methylpiperazin-1-yl)-1-azabicyclo[2.2.2]octane
CID 64932860
[1-(2-bicyclo[2.2.1]heptanyl)-4-ethylpiperidin-2-yl]methanamine
CID 103351615
1-(2,3-dimethylcyclopentyl)-2,5-diethyl-5-methylpiperazine
CID 64939777
4-(2-bicyclo[2.2.1]heptanylmethyl)-3-ethyl-1,4-diazaspiro[5.5]undecane
CID 64939473
2-ethyl-5,5-dimethyl-1-[(2-methylcyclohexyl)methyl]piperazine
CID 64945745

Frequently Asked Questions

What is the IUPAC name of 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine?
The IUPAC name of 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine (CID 64939537) is 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine.
What is the SMILES notation for 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine?
The canonical SMILES for 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine is CCC1CNC(C)(C)CN1C1CC2CCC1C2.
What is the InChIKey of 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine?
The InChIKey is JBKVCQSWOATYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-4-13-9-16-15(2,3)10-17(13)14-8-11-5-6-12(14)7-11/h11-14,16H,4-10H2,1-3H3.
What are the key properties of 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine?
1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine has a molecular weight of 236.40 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bicyclo[2.2.1]heptanyl)-2-ethyl-5,5-dimethylpiperazine is sourced from PubChem (CID 64939537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).