2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine

C17H32N2O — CID 103141210

IUPAC2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
SMILESCC1CN(CC2CCC(C)O2)C(C2CCCCC2)CN1
InChIInChI=1S/C17H32N2O/c1-13-11-19(12-16-9-8-14(2)20-16)17(10-18-13)15-6-4-3-5-7-15/h13-18H,3-12H2,1-2H3
InChIKeyVDRVSCBLFVDMER-UHFFFAOYSA-N
MW280.46 g/mol
LogP2.80
Rot. Bonds3

About 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine

2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine (PubChem CID 103141210) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine.

Molecular Properties

Compound Name2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
PubChem CID103141210
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
SMILESCC1CN(CC2CCC(C)O2)C(C2CCCCC2)CN1
InChIInChI=1S/C17H32N2O/c1-13-11-19(12-16-9-8-14(2)20-16)17(10-18-13)15-6-4-3-5-7-15/h13-18H,3-12H2,1-2H3
InChIKeyVDRVSCBLFVDMER-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,5-dimethyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
CID 82837846
2-cyclopropyl-1-[(5-methyloxolan-2-yl)methyl]-5-(2-methylpropyl)piperazine
CID 103141376
2-cyclohexyl-5-methyl-1-pentylpiperazine
CID 64844371
2-cyclohexyl-5-methyl-1-[2-(2-methylpropoxy)ethyl]piperazine
CID 106458521
2-cyclohexyl-1-(3-ethoxypropyl)-5-methylpiperazine
CID 65177857
2-cyclohexyl-5-methyl-1-(3-methylsulfonylpropyl)piperazine
CID 64843977
2-cyclopropyl-5-ethyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine
CID 103141435
1-(2-bicyclo[2.2.1]heptanylmethyl)-2-cyclopropyl-5-methylpiperazine
CID 79550803
1-cyclohexyl-2-cyclopropyl-5-methylpiperazine
CID 82936330
2-cyclohexyl-1-(cyclopentylmethyl)-5-propan-2-ylpiperazine
CID 64839249
2-cyclopropyl-1-(2-methoxyethyl)-5-methylpiperazine
CID 64845102
3-cyclopropyl-1-[(5-methyloxolan-2-yl)methyl]-1,4-diazepane
CID 103141652

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The IUPAC name of 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine (CID 103141210) is 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine.
What is the SMILES notation for 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The canonical SMILES for 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine is CC1CN(CC2CCC(C)O2)C(C2CCCCC2)CN1.
What is the InChIKey of 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
The InChIKey is VDRVSCBLFVDMER-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-13-11-19(12-16-9-8-14(2)20-16)17(10-18-13)15-6-4-3-5-7-15/h13-18H,3-12H2,1-2H3.
What are the key properties of 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine?
2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine has a molecular weight of 280.46 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-5-methyl-1-[(5-methyloxolan-2-yl)methyl]piperazine is sourced from PubChem (CID 103141210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).