2-cyclohexyl-1-hexylpiperazine

C16H32N2 — CID 64846644

IUPAC2-cyclohexyl-1-hexylpiperazine
SMILESCCCCCCN1CCNCC1C1CCCCC1
InChIInChI=1S/C16H32N2/c1-2-3-4-8-12-18-13-11-17-14-16(18)15-9-6-5-7-10-15/h15-17H,2-14H2,1H3
InChIKeyODCNQZJHCVAWGV-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds6

About 2-cyclohexyl-1-hexylpiperazine

2-cyclohexyl-1-hexylpiperazine (PubChem CID 64846644) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-cyclohexyl-1-hexylpiperazine.

Molecular Properties

Compound Name2-cyclohexyl-1-hexylpiperazine
PubChem CID64846644
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-cyclohexyl-1-hexylpiperazine
SMILESCCCCCCN1CCNCC1C1CCCCC1
InChIInChI=1S/C16H32N2/c1-2-3-4-8-12-18-13-11-17-14-16(18)15-9-6-5-7-10-15/h15-17H,2-14H2,1H3
InChIKeyODCNQZJHCVAWGV-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-butyl-2-cyclopropylpiperazine
CID 64833159
2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine
CID 103414076
2-cyclohexyl-1-(2-ethylsulfonylethyl)piperazine
CID 106732784
(2R)-1-dodecyl-2-methylpiperazine
CID 82761023
2-cyclohexyl-5-methyl-1-pentylpiperazine
CID 64844371
2-cyclohexyl-1-hexyl-5,5-dimethylpiperazine
CID 64840300
2-cyclohexyl-1-(2-methylsulfonylethyl)piperazine
CID 64845062
methanol;2-methyl-1-nonylpiperazine
CID 144711987
1-hexyl-7-methyl-1,4-diazepane
CID 64870586
2-cyclopropyl-1-(4-methylpentyl)piperazine
CID 83169348
2-cyclohexyl-1-[2-(2-methylpropoxy)ethyl]piperazine
CID 106458501
1-[(E)-but-2-enyl]-2-cyclohexylpiperazine
CID 107897882

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-hexylpiperazine?
The IUPAC name of 2-cyclohexyl-1-hexylpiperazine (CID 64846644) is 2-cyclohexyl-1-hexylpiperazine.
What is the SMILES notation for 2-cyclohexyl-1-hexylpiperazine?
The canonical SMILES for 2-cyclohexyl-1-hexylpiperazine is CCCCCCN1CCNCC1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-hexylpiperazine?
The InChIKey is ODCNQZJHCVAWGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-2-3-4-8-12-18-13-11-17-14-16(18)15-9-6-5-7-10-15/h15-17H,2-14H2,1H3.
What are the key properties of 2-cyclohexyl-1-hexylpiperazine?
2-cyclohexyl-1-hexylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-hexylpiperazine is sourced from PubChem (CID 64846644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).