6-decan-4-yl-4-methoxypiperidin-3-amine

C16H34N2O — CID 129134739

IUPAC6-decan-4-yl-4-methoxypiperidin-3-amine
SMILESCCCCCCC(CCC)C1CC(OC)C(N)CN1
InChIInChI=1S/C16H34N2O/c1-4-6-7-8-10-13(9-5-2)15-11-16(19-3)14(17)12-18-15/h13-16,18H,4-12,17H2,1-3H3
InChIKeyBGVXRWYZKZTWMY-UHFFFAOYSA-N
MW270.46 g/mol
LogP3.08
Rot. Bonds9

About 6-decan-4-yl-4-methoxypiperidin-3-amine

6-decan-4-yl-4-methoxypiperidin-3-amine (PubChem CID 129134739) has the molecular formula C16H34N2O and a molecular weight of 270.46 g/mol. Its IUPAC name is 6-decan-4-yl-4-methoxypiperidin-3-amine.

Molecular Properties

Compound Name6-decan-4-yl-4-methoxypiperidin-3-amine
PubChem CID129134739
Molecular FormulaC16H34N2O
Molecular Weight270.46 g/mol
Exact Mass270.27
IUPAC Name6-decan-4-yl-4-methoxypiperidin-3-amine
SMILESCCCCCCC(CCC)C1CC(OC)C(N)CN1
InChIInChI=1S/C16H34N2O/c1-4-6-7-8-10-13(9-5-2)15-11-16(19-3)14(17)12-18-15/h13-16,18H,4-12,17H2,1-3H3
InChIKeyBGVXRWYZKZTWMY-UHFFFAOYSA-N
XLogP3.08
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.46
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-decan-4-yl-4-methoxypiperidin-3-amine?
The IUPAC name of 6-decan-4-yl-4-methoxypiperidin-3-amine (CID 129134739) is 6-decan-4-yl-4-methoxypiperidin-3-amine.
What is the SMILES notation for 6-decan-4-yl-4-methoxypiperidin-3-amine?
The canonical SMILES for 6-decan-4-yl-4-methoxypiperidin-3-amine is CCCCCCC(CCC)C1CC(OC)C(N)CN1.
What is the InChIKey of 6-decan-4-yl-4-methoxypiperidin-3-amine?
The InChIKey is BGVXRWYZKZTWMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2O/c1-4-6-7-8-10-13(9-5-2)15-11-16(19-3)14(17)12-18-15/h13-16,18H,4-12,17H2,1-3H3.
What are the key properties of 6-decan-4-yl-4-methoxypiperidin-3-amine?
6-decan-4-yl-4-methoxypiperidin-3-amine has a molecular weight of 270.46 g/mol, XLogP of 3.08, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-decan-4-yl-4-methoxypiperidin-3-amine is sourced from PubChem (CID 129134739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).