5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine

C16H32N2O — CID 64947348

IUPAC5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine
SMILESCCC1CNC(C(C)(C)C)CN1C1CCCC1OC
InChIInChI=1S/C16H32N2O/c1-6-12-10-17-15(16(2,3)4)11-18(12)13-8-7-9-14(13)19-5/h12-15,17H,6-11H2,1-5H3
InChIKeyCCVZNYSOVOIEPO-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.65
Rot. Bonds3

About 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine

5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine (PubChem CID 64947348) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine.

Molecular Properties

Compound Name5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine
PubChem CID64947348
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine
SMILESCCC1CNC(C(C)(C)C)CN1C1CCCC1OC
InChIInChI=1S/C16H32N2O/c1-6-12-10-17-15(16(2,3)4)11-18(12)13-8-7-9-14(13)19-5/h12-15,17H,6-11H2,1-5H3
InChIKeyCCVZNYSOVOIEPO-UHFFFAOYSA-N
XLogP2.65
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-diethyl-1-(2-methoxycyclopentyl)piperazine
CID 64946212
5-tert-butyl-2-ethyl-1-(2-methyloxolan-3-yl)piperazine
CID 82737366
5-tert-butyl-2-ethyl-1-(4-ethylcyclohexyl)piperazine
CID 64948153
5-tert-butyl-1-(4,4-dimethylcyclohexyl)-2-ethylpiperazine
CID 64941461
4-(5-tert-butyl-2-ethylpiperazin-1-yl)thiane 1,1-dioxide
CID 64935035
3-(5-tert-butyl-2-ethylpiperazin-1-yl)thiolane 1,1-dioxide
CID 64932588
5-tert-butyl-2-ethyl-1-(1-methoxybutan-2-yl)piperazine
CID 64940687
(2R)-2-(bromomethyl)-1-(2-methoxycyclopentyl)pyrrolidine
CID 164655945
5-tert-butyl-1-(2,3-dihydro-1-benzofuran-3-yl)-2-ethylpiperazine
CID 64941260
5-tert-butyl-2-ethyl-1-(3,4,5-trifluorophenyl)piperazine
CID 64940572
5-tert-butyl-2-ethyl-1-phenylpiperazine
CID 64932615
2-ethyl-1-(2-methylcyclopentyl)-5-propan-2-ylpiperazine
CID 64938386

Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine?
The IUPAC name of 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine (CID 64947348) is 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine.
What is the SMILES notation for 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine?
The canonical SMILES for 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine is CCC1CNC(C(C)(C)C)CN1C1CCCC1OC.
What is the InChIKey of 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine?
The InChIKey is CCVZNYSOVOIEPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-6-12-10-17-15(16(2,3)4)11-18(12)13-8-7-9-14(13)19-5/h12-15,17H,6-11H2,1-5H3.
What are the key properties of 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine?
5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine has a molecular weight of 268.44 g/mol, XLogP of 2.65, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-2-ethyl-1-(2-methoxycyclopentyl)piperazine is sourced from PubChem (CID 64947348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).