1-cyclooctyl-5-cyclopropyl-2-methylpiperazine

C16H30N2 — CID 64931171

IUPAC1-cyclooctyl-5-cyclopropyl-2-methylpiperazine
SMILESCC1CNC(C2CC2)CN1C1CCCCCCC1
InChIInChI=1S/C16H30N2/c1-13-11-17-16(14-9-10-14)12-18(13)15-7-5-3-2-4-6-8-15/h13-17H,2-12H2,1H3
InChIKeyQJWNMJNVSXSBAL-UHFFFAOYSA-N
MW250.43 g/mol
LogP3.17
Rot. Bonds2

About 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine

1-cyclooctyl-5-cyclopropyl-2-methylpiperazine (PubChem CID 64931171) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine.

Molecular Properties

Compound Name1-cyclooctyl-5-cyclopropyl-2-methylpiperazine
PubChem CID64931171
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name1-cyclooctyl-5-cyclopropyl-2-methylpiperazine
SMILESCC1CNC(C2CC2)CN1C1CCCCCCC1
InChIInChI=1S/C16H30N2/c1-13-11-17-16(14-9-10-14)12-18(13)15-7-5-3-2-4-6-8-15/h13-17H,2-12H2,1H3
InChIKeyQJWNMJNVSXSBAL-UHFFFAOYSA-N
XLogP3.17
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclohexyl-2-methyl-1-(3-methylcyclopentyl)piperazine
CID 114551124
3-(5-cyclopropyl-2-methylpiperazin-1-yl)-9-methyl-9-azabicyclo[3.3.1]nonane
CID 65470919
1-cycloheptyl-5-cyclopropyl-2-(2-methylpropyl)piperazine
CID 82936451
1-cyclopentyl-5-cyclopropyl-2-(2-methylpropyl)piperazine
CID 82936537
1-cyclopropyl-2,5-dimethylpiperazine
CID 64954280
1-cyclohexyl-2-cyclopropyl-5-methylpiperazine
CID 82936330
(2S,5S)-1-cyclopropyl-2,5-dimethylpiperazine;dihydrochloride
CID 162342302
5-cyclohexyl-2-methyl-1-(2,2,2-trifluoroethyl)piperazine
CID 64860745
2,5-dimethyl-1-(oxepan-4-yl)piperazine
CID 65078858
5-cyclohexyl-1-(3-methoxypropyl)-2-methylpiperazine
CID 64860169
2,5-dimethyl-1-(4-propan-2-ylcycloheptyl)piperazine
CID 65089178
5-butan-2-yl-1-cyclobutyl-2-methylpiperazine
CID 64938367

Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine?
The IUPAC name of 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine (CID 64931171) is 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine.
What is the SMILES notation for 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine?
The canonical SMILES for 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine is CC1CNC(C2CC2)CN1C1CCCCCCC1.
What is the InChIKey of 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine?
The InChIKey is QJWNMJNVSXSBAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-13-11-17-16(14-9-10-14)12-18(13)15-7-5-3-2-4-6-8-15/h13-17H,2-12H2,1H3.
What are the key properties of 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine?
1-cyclooctyl-5-cyclopropyl-2-methylpiperazine has a molecular weight of 250.43 g/mol, XLogP of 3.17, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-5-cyclopropyl-2-methylpiperazine is sourced from PubChem (CID 64931171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).