2-cyclohexyl-5-methyl-1-pentylpiperazine

C16H32N2 — CID 64844371

IUPAC2-cyclohexyl-5-methyl-1-pentylpiperazine
SMILESCCCCCN1CC(C)NCC1C1CCCCC1
InChIInChI=1S/C16H32N2/c1-3-4-8-11-18-13-14(2)17-12-16(18)15-9-6-5-7-10-15/h14-17H,3-13H2,1-2H3
InChIKeyGKGNSWFZWISRPO-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.42
Rot. Bonds5

About 2-cyclohexyl-5-methyl-1-pentylpiperazine

2-cyclohexyl-5-methyl-1-pentylpiperazine (PubChem CID 64844371) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-cyclohexyl-5-methyl-1-pentylpiperazine.

Molecular Properties

Compound Name2-cyclohexyl-5-methyl-1-pentylpiperazine
PubChem CID64844371
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-cyclohexyl-5-methyl-1-pentylpiperazine
SMILESCCCCCN1CC(C)NCC1C1CCCCC1
InChIInChI=1S/C16H32N2/c1-3-4-8-11-18-13-14(2)17-12-16(18)15-9-6-5-7-10-15/h14-17H,3-13H2,1-2H3
InChIKeyGKGNSWFZWISRPO-UHFFFAOYSA-N
XLogP3.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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

2-cyclohexyl-1-(3-ethoxypropyl)-5-methylpiperazine
CID 65177857
2-cyclohexyl-5-methyl-1-(3-methylsulfonylpropyl)piperazine
CID 64843977
1-butyl-2-cyclohexyl-5-cyclopropylpiperazine
CID 64861672
2,5-dicyclopropyl-1-pentylpiperazine
CID 64859934
2-cyclohexyl-1-hexylpiperazine
CID 64846644
1-dodecyl-2,5-dimethylpiperazine
CID 3030143
2-cyclohexyl-5-methyl-1-[2-(2-methylpropoxy)ethyl]piperazine
CID 106458521
2-cyclohexyl-1-hexyl-5,5-dimethylpiperazine
CID 64840300
5-tert-butyl-2-cyclopropyl-1-octylpiperazine
CID 64841844
2-cyclopropyl-5-methyl-1-(4-phenylbutyl)piperazine
CID 114334917
2-cyclohexyl-1-(4-methylpentyl)-5-propylpiperazine
CID 83148151
2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine
CID 64845102

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-methyl-1-pentylpiperazine?
The IUPAC name of 2-cyclohexyl-5-methyl-1-pentylpiperazine (CID 64844371) is 2-cyclohexyl-5-methyl-1-pentylpiperazine.
What is the SMILES notation for 2-cyclohexyl-5-methyl-1-pentylpiperazine?
The canonical SMILES for 2-cyclohexyl-5-methyl-1-pentylpiperazine is CCCCCN1CC(C)NCC1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-5-methyl-1-pentylpiperazine?
The InChIKey is GKGNSWFZWISRPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-3-4-8-11-18-13-14(2)17-12-16(18)15-9-6-5-7-10-15/h14-17H,3-13H2,1-2H3.
What are the key properties of 2-cyclohexyl-5-methyl-1-pentylpiperazine?
2-cyclohexyl-5-methyl-1-pentylpiperazine has a molecular weight of 252.45 g/mol, XLogP of 3.42, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-methyl-1-pentylpiperazine is sourced from PubChem (CID 64844371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).