1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine

C16H34N2 — CID 114201402

IUPAC1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine
SMILESCCC1(CC)CN(CC(C)CC(C)C)C(C)CN1
InChIInChI=1S/C16H34N2/c1-7-16(8-2)12-18(15(6)10-17-16)11-14(5)9-13(3)4/h13-15,17H,7-12H2,1-6H3
InChIKeyHHVCHEFQLMSWCZ-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds6

About 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine

1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine (PubChem CID 114201402) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine.

Molecular Properties

Compound Name1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine
PubChem CID114201402
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine
SMILESCCC1(CC)CN(CC(C)CC(C)C)C(C)CN1
InChIInChI=1S/C16H34N2/c1-7-16(8-2)12-18(15(6)10-17-16)11-14(5)9-13(3)4/h13-15,17H,7-12H2,1-6H3
InChIKeyHHVCHEFQLMSWCZ-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5,5-diethyl-2-methyl-1-(3-methylbutyl)piperazine
CID 64862336
5,5-diethyl-1-(2-methylbutyl)-2-(2-methylpropyl)piperazine
CID 64862556
8-methyl-9-(2-methylpentyl)-6,9-diazaspiro[4.5]decane
CID 64875816
5,5-diethyl-2-methyl-1-(3,3,3-trifluoropropyl)piperazine
CID 64860416
5,5-diethyl-2-methyl-1-(2-methylsulfonylethyl)piperazine
CID 64860997
1-benzyl-5,5-diethyl-2-methylpiperazine
CID 64862341
3-methyl-4-(2-methylpropyl)-1,4-diazaspiro[5.5]undecane
CID 64877798
5,5-diethyl-1-[(1-ethylpiperidin-4-yl)methyl]-2-methylpiperazine
CID 64947875
5,5-diethyl-2-methyl-1-(2-methylcyclopropyl)piperazine
CID 64948522
1-cyclobutyl-5,5-diethyl-2-methylpiperazine
CID 64948334
5,5-diethyl-1-[1-(4-fluorophenyl)ethyl]-2-methylpiperazine
CID 64946647
5,5-diethyl-2-methyl-1-[1-(trifluoromethyl)cyclopropyl]piperazine
CID 114158814

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine?
The IUPAC name of 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine (CID 114201402) is 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine.
What is the SMILES notation for 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine?
The canonical SMILES for 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine is CCC1(CC)CN(CC(C)CC(C)C)C(C)CN1.
What is the InChIKey of 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine?
The InChIKey is HHVCHEFQLMSWCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-7-16(8-2)12-18(15(6)10-17-16)11-14(5)9-13(3)4/h13-15,17H,7-12H2,1-6H3.
What are the key properties of 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine?
1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dimethylpentyl)-5,5-diethyl-2-methylpiperazine is sourced from PubChem (CID 114201402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).