2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine

C16H32N2O2 — CID 103414076

IUPAC2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine
SMILESCOCCOCCCN1CCNCC1C1CCCCC1
InChIInChI=1S/C16H32N2O2/c1-19-12-13-20-11-5-9-18-10-8-17-14-16(18)15-6-3-2-4-7-15/h15-17H,2-14H2,1H3
InChIKeyOHPALOGCHFUHQW-UHFFFAOYSA-N
MW284.44 g/mol
LogP1.89
Rot. Bonds8

About 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine

2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine (PubChem CID 103414076) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine.

Molecular Properties

Compound Name2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine
PubChem CID103414076
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine
SMILESCOCCOCCCN1CCNCC1C1CCCCC1
InChIInChI=1S/C16H32N2O2/c1-19-12-13-20-11-5-9-18-10-8-17-14-16(18)15-6-3-2-4-7-15/h15-17H,2-14H2,1H3
InChIKeyOHPALOGCHFUHQW-UHFFFAOYSA-N
XLogP1.89
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[3-(2-methoxyethoxy)propyl]-2-methylpiperazine
CID 103410154
2-cyclohexyl-1-hexylpiperazine
CID 64846644
2-cyclohexyl-1-[2-(2-methylpropoxy)ethyl]piperazine
CID 106458501
1-[3-(2-methoxyethoxy)propyl]-7-methyl-1,4-diazepane
CID 103414508
1-(3-methoxypropyl)-2-piperidin-4-ylazepane
CID 64852585
3-[1-(3-methoxypropyl)pyrrolidin-2-yl]piperidine
CID 66273644
1-(3-methoxypropyl)-2-methylpiperazine
CID 62674205
1-butyl-2-cyclopropylpiperazine
CID 64833159
2-cyclohexyl-1-(2-ethylsulfonylethyl)piperazine
CID 106732784
2-cyclohexyl-1-(2-methylsulfonylethyl)piperazine
CID 64845062
1-(2-methoxyethyl)-2,3,4,4a,5,6,7,7a-octahydropyrrolo[3,4-b]pyridine
CID 102681300
2-cyclohexyl-5-cyclopropyl-1-(4-methoxybutyl)piperazine
CID 104650306

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine?
The IUPAC name of 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine (CID 103414076) is 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine.
What is the SMILES notation for 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine?
The canonical SMILES for 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine is COCCOCCCN1CCNCC1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine?
The InChIKey is OHPALOGCHFUHQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-19-12-13-20-11-5-9-18-10-8-17-14-16(18)15-6-3-2-4-7-15/h15-17H,2-14H2,1H3.
What are the key properties of 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine?
2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine has a molecular weight of 284.44 g/mol, XLogP of 1.89, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-[3-(2-methoxyethoxy)propyl]piperazine is sourced from PubChem (CID 103414076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).