1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine

C17H34N2 — CID 64848291

IUPAC1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine
SMILESCCC1(C)CN(CC2CCCCC2)C(C(C)C)CN1
InChIInChI=1S/C17H34N2/c1-5-17(4)13-19(16(11-18-17)14(2)3)12-15-9-7-6-8-10-15/h14-16,18H,5-13H2,1-4H3
InChIKeyITLXTZHKURJWIZ-UHFFFAOYSA-N
MW266.47 g/mol
LogP3.67
Rot. Bonds4

About 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine

1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine (PubChem CID 64848291) has the molecular formula C17H34N2 and a molecular weight of 266.47 g/mol. Its IUPAC name is 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine
PubChem CID64848291
Molecular FormulaC17H34N2
Molecular Weight266.47 g/mol
Exact Mass266.27
IUPAC Name1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine
SMILESCCC1(C)CN(CC2CCCCC2)C(C(C)C)CN1
InChIInChI=1S/C17H34N2/c1-5-17(4)13-19(16(11-18-17)14(2)3)12-15-9-7-6-8-10-15/h14-16,18H,5-13H2,1-4H3
InChIKeyITLXTZHKURJWIZ-UHFFFAOYSA-N
XLogP3.67
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 ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(cyclohexylmethyl)-5-ethyl-2,5-dimethylpiperazine
CID 64847892
5-ethyl-5-methyl-1-(2-methylsulfanylethyl)-2-propan-2-ylpiperazine
CID 64940459
1-(cyclobutylmethyl)-5-ethyl-5-methyl-2-(2-methylpropyl)piperazine
CID 65463085
1-(cyclopropylmethyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64840273
5-ethyl-1-(3-fluoropropyl)-5-methyl-2-propan-2-ylpiperazine
CID 81113589
1-[(1,4-dimethylpiperazin-2-yl)methyl]-5-ethyl-5-methyl-2-propan-2-ylpiperazine
CID 64939876
5-ethyl-5-methyl-1-(5-methylhexyl)-2-propan-2-ylpiperazine
CID 115327069
5-ethyl-5-methyl-2-propan-2-yl-1-(3-propoxypropyl)piperazine
CID 82947083
5-ethyl-5-methyl-1-[2-(oxolan-2-yl)ethyl]-2-propan-2-ylpiperazine
CID 64945561
2-butan-2-yl-1-(cyclopentylmethyl)-5,5-diethylpiperazine
CID 64861206
5-ethyl-1-(4-methoxybutyl)-5-methyl-2-propan-2-ylpiperazine
CID 64947304
5-ethyl-5-methyl-1-[3-(oxolan-2-yl)propyl]-2-propan-2-ylpiperazine
CID 65170433

Frequently Asked Questions

What is the IUPAC name of 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine?
The IUPAC name of 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine (CID 64848291) is 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine?
The canonical SMILES for 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine is CCC1(C)CN(CC2CCCCC2)C(C(C)C)CN1.
What is the InChIKey of 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine?
The InChIKey is ITLXTZHKURJWIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2/c1-5-17(4)13-19(16(11-18-17)14(2)3)12-15-9-7-6-8-10-15/h14-16,18H,5-13H2,1-4H3.
What are the key properties of 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine?
1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine has a molecular weight of 266.47 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclohexylmethyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine is sourced from PubChem (CID 64848291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).