2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine

C19H32N2 — CID 64849498

IUPAC2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine
SMILESCCc1ccc(CN2CC(CC(C)C)NCC2CC)cc1
InChIInChI=1S/C19H32N2/c1-5-16-7-9-17(10-8-16)13-21-14-18(11-15(3)4)20-12-19(21)6-2/h7-10,15,18-20H,5-6,11-14H2,1-4H3
InChIKeyIDUHZLQWRBHZGO-UHFFFAOYSA-N
MW288.48 g/mol
LogP3.85
Rot. Bonds6

About 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine

2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine (PubChem CID 64849498) has the molecular formula C19H32N2 and a molecular weight of 288.48 g/mol. Its IUPAC name is 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine
PubChem CID64849498
Molecular FormulaC19H32N2
Molecular Weight288.48 g/mol
Exact Mass288.26
IUPAC Name2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine
SMILESCCc1ccc(CN2CC(CC(C)C)NCC2CC)cc1
InChIInChI=1S/C19H32N2/c1-5-16-7-9-17(10-8-16)13-21-14-18(11-15(3)4)20-12-19(21)6-2/h7-10,15,18-20H,5-6,11-14H2,1-4H3
InChIKeyIDUHZLQWRBHZGO-UHFFFAOYSA-N
XLogP3.85
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.48
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-ethyl-1-[(4-methoxyphenyl)methyl]-5-(2-methylpropyl)piperazine
CID 64848535
2,5-diethyl-1-[(4-ethylphenyl)methyl]piperazine
CID 64842304
2-ethyl-1-[(5-ethylthiophen-2-yl)methyl]-5-(2-methylpropyl)piperazine
CID 64849112
2-ethyl-1-[(3-methoxyphenyl)methyl]-5-(2-methylpropyl)piperazine
CID 64849307
4-[[2-ethyl-5-(2-methylpropyl)piperazin-1-yl]methyl]-2-methylpyrimidine
CID 64946749
3-[[2-ethyl-5-(2-methylpropyl)piperazin-1-yl]methyl]-5-methyl-1,2-oxazole
CID 64946354
4-[[2-ethyl-5-(2-methylpropyl)piperazin-1-yl]methyl]-1,3-thiazole
CID 64939479
1-[(3,4-dichlorophenyl)methyl]-2,5-diethylpiperazine
CID 64842881
1-(2,3-dimethylbutyl)-2-ethyl-5-(2-methylpropyl)piperazine
CID 64941869
2-ethyl-1-(2-ethylbutyl)-5-(2-methylpropyl)piperazine
CID 82925413
2-ethyl-5-(2-methylpropyl)-1-(2-thiophen-3-ylethyl)piperazine
CID 64849303
2-ethyl-1-(5-methylhexyl)-5-(2-methylpropyl)piperazine
CID 115327036

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine?
The IUPAC name of 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine (CID 64849498) is 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine.
What is the SMILES notation for 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine?
The canonical SMILES for 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine is CCc1ccc(CN2CC(CC(C)C)NCC2CC)cc1.
What is the InChIKey of 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine?
The InChIKey is IDUHZLQWRBHZGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N2/c1-5-16-7-9-17(10-8-16)13-21-14-18(11-15(3)4)20-12-19(21)6-2/h7-10,15,18-20H,5-6,11-14H2,1-4H3.
What are the key properties of 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine?
2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine has a molecular weight of 288.48 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-[(4-ethylphenyl)methyl]-5-(2-methylpropyl)piperazine is sourced from PubChem (CID 64849498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).