1-cycloheptyl-2,2-diethyl-5-propylpiperazine

C18H36N2 — CID 82936429

IUPAC1-cycloheptyl-2,2-diethyl-5-propylpiperazine
SMILESCCCC1CN(C2CCCCCC2)C(CC)(CC)CN1
InChIInChI=1S/C18H36N2/c1-4-11-16-14-20(17-12-9-7-8-10-13-17)18(5-2,6-3)15-19-16/h16-17,19H,4-15H2,1-3H3
InChIKeyKGSHYRUURSGLPR-UHFFFAOYSA-N
MW280.50 g/mol
LogP4.34
Rot. Bonds5

About 1-cycloheptyl-2,2-diethyl-5-propylpiperazine

1-cycloheptyl-2,2-diethyl-5-propylpiperazine (PubChem CID 82936429) has the molecular formula C18H36N2 and a molecular weight of 280.50 g/mol. Its IUPAC name is 1-cycloheptyl-2,2-diethyl-5-propylpiperazine.

Molecular Properties

Compound Name1-cycloheptyl-2,2-diethyl-5-propylpiperazine
PubChem CID82936429
Molecular FormulaC18H36N2
Molecular Weight280.50 g/mol
Exact Mass280.29
IUPAC Name1-cycloheptyl-2,2-diethyl-5-propylpiperazine
SMILESCCCC1CN(C2CCCCCC2)C(CC)(CC)CN1
InChIInChI=1S/C18H36N2/c1-4-11-16-14-20(17-12-9-7-8-10-13-17)18(5-2,6-3)15-19-16/h16-17,19H,4-15H2,1-3H3
InChIKeyKGSHYRUURSGLPR-UHFFFAOYSA-N
XLogP4.34
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.50
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cycloheptyl-2-cyclopropyl-2-methyl-5-propylpiperazine
CID 82937285
1-(cyclopropylmethyl)-2,2-diethyl-5-propylpiperazine
CID 64840755
2,2-diethyl-1-pentyl-5-propylpiperazine
CID 64839985
1-cyclooctyl-3-propylpiperazine
CID 64924184
2-ethyl-2-methyl-1-(oxolan-3-yl)-5-propylpiperazine
CID 64840364
1,2-dicyclohexyl-5-propylpiperazine
CID 82923889
1-cyclohexyl-2,2-dimethyl-5-(2-methylpropyl)piperazine
CID 82936775
1-(cyclopentylmethyl)-2,2,5-triethylpiperazine
CID 64841400
2-tert-butyl-1-cyclohexyl-5-propylpiperazine
CID 82936428
1-cyclooctyl-2-propan-2-yl-5-propylpiperazine
CID 64931569
1-[(4-bromophenyl)methyl]-2,2-diethyl-5-propylpiperazine
CID 64840562
1-(cyclobutylmethyl)-3-propyl-1,4-diazaspiro[5.5]undecane
CID 65460666

Frequently Asked Questions

What is the IUPAC name of 1-cycloheptyl-2,2-diethyl-5-propylpiperazine?
The IUPAC name of 1-cycloheptyl-2,2-diethyl-5-propylpiperazine (CID 82936429) is 1-cycloheptyl-2,2-diethyl-5-propylpiperazine.
What is the SMILES notation for 1-cycloheptyl-2,2-diethyl-5-propylpiperazine?
The canonical SMILES for 1-cycloheptyl-2,2-diethyl-5-propylpiperazine is CCCC1CN(C2CCCCCC2)C(CC)(CC)CN1.
What is the InChIKey of 1-cycloheptyl-2,2-diethyl-5-propylpiperazine?
The InChIKey is KGSHYRUURSGLPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H36N2/c1-4-11-16-14-20(17-12-9-7-8-10-13-17)18(5-2,6-3)15-19-16/h16-17,19H,4-15H2,1-3H3.
What are the key properties of 1-cycloheptyl-2,2-diethyl-5-propylpiperazine?
1-cycloheptyl-2,2-diethyl-5-propylpiperazine has a molecular weight of 280.50 g/mol, XLogP of 4.34, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cycloheptyl-2,2-diethyl-5-propylpiperazine is sourced from PubChem (CID 82936429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).