2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine

C17H36N2 — CID 43266378

IUPAC2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine
SMILESCCCCCCCC(C)(CN)N1CCCCC1CC
InChIInChI=1S/C17H36N2/c1-4-6-7-8-10-13-17(3,15-18)19-14-11-9-12-16(19)5-2/h16H,4-15,18H2,1-3H3
InChIKeyNGYIXJXYLPSPRE-UHFFFAOYSA-N
MW268.49 g/mol
LogP4.33
Rot. Bonds9

About 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine

2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine (PubChem CID 43266378) has the molecular formula C17H36N2 and a molecular weight of 268.49 g/mol. Its IUPAC name is 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine.

Molecular Properties

Compound Name2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine
PubChem CID43266378
Molecular FormulaC17H36N2
Molecular Weight268.49 g/mol
Exact Mass268.29
IUPAC Name2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine
SMILESCCCCCCCC(C)(CN)N1CCCCC1CC
InChIInChI=1S/C17H36N2/c1-4-6-7-8-10-13-17(3,15-18)19-14-11-9-12-16(19)5-2/h16H,4-15,18H2,1-3H3
InChIKeyNGYIXJXYLPSPRE-UHFFFAOYSA-N
XLogP4.33
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.49
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine?
The IUPAC name of 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine (CID 43266378) is 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine.
What is the SMILES notation for 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine?
The canonical SMILES for 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine is CCCCCCCC(C)(CN)N1CCCCC1CC.
What is the InChIKey of 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine?
The InChIKey is NGYIXJXYLPSPRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36N2/c1-4-6-7-8-10-13-17(3,15-18)19-14-11-9-12-16(19)5-2/h16H,4-15,18H2,1-3H3.
What are the key properties of 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine?
2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine has a molecular weight of 268.49 g/mol, XLogP of 4.33, 9 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylpiperidin-1-yl)-2-methylnonan-1-amine is sourced from PubChem (CID 43266378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).