2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine

C15H30N2 — CID 62123733

IUPAC2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine
SMILESCC1CCCN(C2CCCCCCC2N)C1C
InChIInChI=1S/C15H30N2/c1-12-8-7-11-17(13(12)2)15-10-6-4-3-5-9-14(15)16/h12-15H,3-11,16H2,1-2H3
InChIKeyGKIPODCJNXRWJT-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.16
Rot. Bonds1

About 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine

2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine (PubChem CID 62123733) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine.

Molecular Properties

Compound Name2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine
PubChem CID62123733
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine
SMILESCC1CCCN(C2CCCCCCC2N)C1C
InChIInChI=1S/C15H30N2/c1-12-8-7-11-17(13(12)2)15-10-6-4-3-5-9-14(15)16/h12-15H,3-11,16H2,1-2H3
InChIKeyGKIPODCJNXRWJT-UHFFFAOYSA-N
XLogP3.16
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine?
The IUPAC name of 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine (CID 62123733) is 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine.
What is the SMILES notation for 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine?
The canonical SMILES for 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine is CC1CCCN(C2CCCCCCC2N)C1C.
What is the InChIKey of 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine?
The InChIKey is GKIPODCJNXRWJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-12-8-7-11-17(13(12)2)15-10-6-4-3-5-9-14(15)16/h12-15H,3-11,16H2,1-2H3.
What are the key properties of 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine?
2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine has a molecular weight of 238.42 g/mol, XLogP of 3.16, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dimethylpiperidin-1-yl)cyclooctan-1-amine is sourced from PubChem (CID 62123733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).