2,5-diethyl-1-hexan-2-ylpiperazine

C14H30N2 — CID 64947739

IUPAC2,5-diethyl-1-hexan-2-ylpiperazine
SMILESCCCCC(C)N1CC(CC)NCC1CC
InChIInChI=1S/C14H30N2/c1-5-8-9-12(4)16-11-13(6-2)15-10-14(16)7-3/h12-15H,5-11H2,1-4H3
InChIKeyNHUPTEPCTRCVTI-UHFFFAOYSA-N
MW226.41 g/mol
LogP3.03
Rot. Bonds6

About 2,5-diethyl-1-hexan-2-ylpiperazine

2,5-diethyl-1-hexan-2-ylpiperazine (PubChem CID 64947739) has the molecular formula C14H30N2 and a molecular weight of 226.41 g/mol. Its IUPAC name is 2,5-diethyl-1-hexan-2-ylpiperazine.

Molecular Properties

Compound Name2,5-diethyl-1-hexan-2-ylpiperazine
PubChem CID64947739
Molecular FormulaC14H30N2
Molecular Weight226.41 g/mol
Exact Mass226.24
IUPAC Name2,5-diethyl-1-hexan-2-ylpiperazine
SMILESCCCCC(C)N1CC(CC)NCC1CC
InChIInChI=1S/C14H30N2/c1-5-8-9-12(4)16-11-13(6-2)15-10-14(16)7-3/h12-15H,5-11H2,1-4H3
InChIKeyNHUPTEPCTRCVTI-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.41
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-diethyl-1-octan-2-ylpiperazine
CID 64946640
2-ethyl-1-hexan-2-yl-5-propan-2-ylpiperazine
CID 64936630
2-ethyl-1-(6-methylheptan-2-yl)-5-propylpiperazine
CID 64948165
5-butan-2-yl-2-ethyl-1-hexan-2-ylpiperazine
CID 64936824
2-ethyl-1-hexan-2-ylaziridine
CID 167041728
3-(2,5-diethylpiperazin-1-yl)butanoic acid
CID 64979155
1-but-3-en-2-yl-2,5-diethylpiperazine
CID 64978837
2-ethyl-1-(1-methoxypropan-2-yl)-5-propylpiperazine
CID 64932571
2,5-diethyl-1-[1-(5-methylthiophen-2-yl)propan-2-yl]piperazine
CID 64941276
2-butan-2-yl-5-ethyl-1-pentan-2-ylpiperazine
CID 114013055
2-ethyl-5-methyl-1-(5-methylhexan-2-yl)piperazine
CID 64938399
1-(2,5-diethylpiperazin-1-yl)-2-ethylhexan-1-one
CID 64978358

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-1-hexan-2-ylpiperazine?
The IUPAC name of 2,5-diethyl-1-hexan-2-ylpiperazine (CID 64947739) is 2,5-diethyl-1-hexan-2-ylpiperazine.
What is the SMILES notation for 2,5-diethyl-1-hexan-2-ylpiperazine?
The canonical SMILES for 2,5-diethyl-1-hexan-2-ylpiperazine is CCCCC(C)N1CC(CC)NCC1CC.
What is the InChIKey of 2,5-diethyl-1-hexan-2-ylpiperazine?
The InChIKey is NHUPTEPCTRCVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c1-5-8-9-12(4)16-11-13(6-2)15-10-14(16)7-3/h12-15H,5-11H2,1-4H3.
What are the key properties of 2,5-diethyl-1-hexan-2-ylpiperazine?
2,5-diethyl-1-hexan-2-ylpiperazine has a molecular weight of 226.41 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-1-hexan-2-ylpiperazine is sourced from PubChem (CID 64947739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).