5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine

C16H34N2 — CID 106027152

IUPAC5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine
SMILESCCCCC(CCC)N1CC(C)NCC1C(C)C
InChIInChI=1S/C16H34N2/c1-6-8-10-15(9-7-2)18-12-14(5)17-11-16(18)13(3)4/h13-17H,6-12H2,1-5H3
InChIKeyFOWNXBWRZVXGON-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.66
Rot. Bonds7

About 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine

5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine (PubChem CID 106027152) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine
PubChem CID106027152
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine
SMILESCCCCC(CCC)N1CC(C)NCC1C(C)C
InChIInChI=1S/C16H34N2/c1-6-8-10-15(9-7-2)18-12-14(5)17-11-16(18)13(3)4/h13-17H,6-12H2,1-5H3
InChIKeyFOWNXBWRZVXGON-UHFFFAOYSA-N
XLogP3.66
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-1-octan-2-yl-2-propan-2-ylpiperazine
CID 64936589
5-ethyl-5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine
CID 106027142
1-but-3-yn-2-yl-5-methyl-2-propan-2-ylpiperazine
CID 114420424
1-(2-butoxyethyl)-5-methyl-2-propan-2-ylpiperazine
CID 64845683
2-butan-2-yl-1-butyl-5-methylpiperazine
CID 64846296
5-methyl-1-(1-phenylpropan-2-yl)-2-propan-2-ylpiperazine
CID 64938383
5-methyl-2-propan-2-yl-1-(1-thiophen-3-ylpropan-2-yl)piperazine
CID 64937748
(2S,5S)-2-ethyl-5-methyl-1-propan-2-ylpiperazine
CID 96769528
1-[(1-ethylpiperidin-4-yl)methyl]-5-methyl-2-propan-2-ylpiperazine
CID 64937578
8-methyl-9-octan-4-yl-6,9-diazaspiro[4.5]decane
CID 106027228
5-methyl-1-[(1-methylcyclopentyl)methyl]-2-propan-2-ylpiperazine
CID 64936660
5-methyl-2-propan-2-yl-1-(2,2,2-trifluoroethyl)piperazine
CID 64845880

Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine?
The IUPAC name of 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine (CID 106027152) is 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine.
What is the SMILES notation for 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine?
The canonical SMILES for 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine is CCCCC(CCC)N1CC(C)NCC1C(C)C.
What is the InChIKey of 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine?
The InChIKey is FOWNXBWRZVXGON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-6-8-10-15(9-7-2)18-12-14(5)17-11-16(18)13(3)4/h13-17H,6-12H2,1-5H3.
What are the key properties of 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine?
5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine has a molecular weight of 254.46 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-octan-4-yl-2-propan-2-ylpiperazine is sourced from PubChem (CID 106027152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).