1-cyclooctyl-4-ethylpiperidine

C15H29N — CID 166912803

IUPAC1-cyclooctyl-4-ethylpiperidine
SMILESCCC1CCN(C2CCCCCCC2)CC1
InChIInChI=1S/C15H29N/c1-2-14-10-12-16(13-11-14)15-8-6-4-3-5-7-9-15/h14-15H,2-13H2,1H3
InChIKeyZVXNNGSXTLUFCF-UHFFFAOYSA-N
MW223.40 g/mol
LogP4.22
Rot. Bonds2

About 1-cyclooctyl-4-ethylpiperidine

1-cyclooctyl-4-ethylpiperidine (PubChem CID 166912803) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 1-cyclooctyl-4-ethylpiperidine.

Molecular Properties

Compound Name1-cyclooctyl-4-ethylpiperidine
PubChem CID166912803
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name1-cyclooctyl-4-ethylpiperidine
SMILESCCC1CCN(C2CCCCCCC2)CC1
InChIInChI=1S/C15H29N/c1-2-14-10-12-16(13-11-14)15-8-6-4-3-5-7-9-15/h14-15H,2-13H2,1H3
InChIKeyZVXNNGSXTLUFCF-UHFFFAOYSA-N
XLogP4.22
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclooctyl-4-ethylpiperidine?
The IUPAC name of 1-cyclooctyl-4-ethylpiperidine (CID 166912803) is 1-cyclooctyl-4-ethylpiperidine.
What is the SMILES notation for 1-cyclooctyl-4-ethylpiperidine?
The canonical SMILES for 1-cyclooctyl-4-ethylpiperidine is CCC1CCN(C2CCCCCCC2)CC1.
What is the InChIKey of 1-cyclooctyl-4-ethylpiperidine?
The InChIKey is ZVXNNGSXTLUFCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-2-14-10-12-16(13-11-14)15-8-6-4-3-5-7-9-15/h14-15H,2-13H2,1H3.
What are the key properties of 1-cyclooctyl-4-ethylpiperidine?
1-cyclooctyl-4-ethylpiperidine has a molecular weight of 223.40 g/mol, XLogP of 4.22, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclooctyl-4-ethylpiperidine is sourced from PubChem (CID 166912803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).