5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine

C17H34N2 — CID 64948246

IUPAC5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine
SMILESCCC1CN(CC2CCCCC2C)C(C(C)C)CN1
InChIInChI=1S/C17H34N2/c1-5-16-12-19(17(10-18-16)13(2)3)11-15-9-7-6-8-14(15)4/h13-18H,5-12H2,1-4H3
InChIKeyNWIPXLLTRPQFOM-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.52
Rot. Bonds4

About 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine

5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine (PubChem CID 64948246) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine
PubChem CID64948246
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine
SMILESCCC1CN(CC2CCCCC2C)C(C(C)C)CN1
InChIInChI=1S/C17H34N2/c1-5-16-12-19(17(10-18-16)13(2)3)11-15-9-7-6-8-14(15)4/h13-18H,5-12H2,1-4H3
InChIKeyNWIPXLLTRPQFOM-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.47
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-butan-2-yl-1-(cyclopentylmethyl)-5-ethylpiperazine
CID 64843292
5-ethyl-1-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64843674
5-ethyl-1-(2-ethylcyclohexyl)-2-propan-2-ylpiperazine
CID 64934196
5-ethyl-1-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylpiperazine
CID 102908491
1-[(2-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine
CID 107420870
2-ethyl-1-[(2-methylcyclopentyl)methyl]-5-propan-2-ylpiperazine
CID 107420868
5-ethyl-1-[2-(4-methylcyclohexyl)ethyl]-2-propan-2-ylpiperazine
CID 64942232
1-[(5,5-dimethyloxolan-2-yl)methyl]-5-ethyl-2-propan-2-ylpiperazine
CID 116524491
5-ethyl-1-(2-methylsulfonylethyl)-2-propan-2-ylpiperazine
CID 64841740
1-(cyclobutylmethyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 64934807
2-[(5-ethyl-2-propan-2-ylpiperazin-1-yl)methyl]-4-methylmorpholine
CID 79077325
5-ethyl-1-[2-(1-methylpiperidin-4-yl)ethyl]-2-propan-2-ylpiperazine
CID 114516829

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine?
The IUPAC name of 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine (CID 64948246) is 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine?
The canonical SMILES for 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine is CCC1CN(CC2CCCCC2C)C(C(C)C)CN1.
What is the InChIKey of 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine?
The InChIKey is NWIPXLLTRPQFOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-5-16-12-19(17(10-18-16)13(2)3)11-15-9-7-6-8-14(15)4/h13-18H,5-12H2,1-4H3.
What are the key properties of 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine?
5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine has a molecular weight of 266.47 g/mol, XLogP of 3.52, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-1-[(2-methylcyclohexyl)methyl]-2-propan-2-ylpiperazine is sourced from PubChem (CID 64948246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).