1-cyclooctyl-3-cyclopropylpiperazine

C15H28N2 — CID 64924583

IUPAC1-cyclooctyl-3-cyclopropylpiperazine
SMILESC1CCCC(N2CCNC(C3CC3)C2)CCC1
InChIInChI=1S/C15H28N2/c1-2-4-6-14(7-5-3-1)17-11-10-16-15(12-17)13-8-9-13/h13-16H,1-12H2
InChIKeyMMXKVNNLLFHDAO-UHFFFAOYSA-N
MW236.40 g/mol
LogP2.78
Rot. Bonds2

About 1-cyclooctyl-3-cyclopropylpiperazine

1-cyclooctyl-3-cyclopropylpiperazine (PubChem CID 64924583) has the molecular formula C15H28N2 and a molecular weight of 236.40 g/mol. Its IUPAC name is 1-cyclooctyl-3-cyclopropylpiperazine.

Molecular Properties

Compound Name1-cyclooctyl-3-cyclopropylpiperazine
PubChem CID64924583
Molecular FormulaC15H28N2
Molecular Weight236.40 g/mol
Exact Mass236.23
IUPAC Name1-cyclooctyl-3-cyclopropylpiperazine
SMILESC1CCCC(N2CCNC(C3CC3)C2)CCC1
InChIInChI=1S/C15H28N2/c1-2-4-6-14(7-5-3-1)17-11-10-16-15(12-17)13-8-9-13/h13-16H,1-12H2
InChIKeyMMXKVNNLLFHDAO-UHFFFAOYSA-N
XLogP2.78
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.40
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-3-cyclopropylpiperazine?
The IUPAC name of 1-cyclooctyl-3-cyclopropylpiperazine (CID 64924583) is 1-cyclooctyl-3-cyclopropylpiperazine.
What is the SMILES notation for 1-cyclooctyl-3-cyclopropylpiperazine?
The canonical SMILES for 1-cyclooctyl-3-cyclopropylpiperazine is C1CCCC(N2CCNC(C3CC3)C2)CCC1.
What is the InChIKey of 1-cyclooctyl-3-cyclopropylpiperazine?
The InChIKey is MMXKVNNLLFHDAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2/c1-2-4-6-14(7-5-3-1)17-11-10-16-15(12-17)13-8-9-13/h13-16H,1-12H2.
What are the key properties of 1-cyclooctyl-3-cyclopropylpiperazine?
1-cyclooctyl-3-cyclopropylpiperazine has a molecular weight of 236.40 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-3-cyclopropylpiperazine is sourced from PubChem (CID 64924583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).