2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine

C16H32N2 — CID 63157458

IUPAC2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine
SMILESCCC1(CC)CCN(C(CN)C2CCCC2)CC1
InChIInChI=1S/C16H32N2/c1-3-16(4-2)9-11-18(12-10-16)15(13-17)14-7-5-6-8-14/h14-15H,3-13,17H2,1-2H3
InChIKeyWASXQFWZRRUSGD-UHFFFAOYSA-N
MW252.45 g/mol
LogP3.41
Rot. Bonds5

About 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine

2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine (PubChem CID 63157458) has the molecular formula C16H32N2 and a molecular weight of 252.45 g/mol. Its IUPAC name is 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine
PubChem CID63157458
Molecular FormulaC16H32N2
Molecular Weight252.45 g/mol
Exact Mass252.26
IUPAC Name2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine
SMILESCCC1(CC)CCN(C(CN)C2CCCC2)CC1
InChIInChI=1S/C16H32N2/c1-3-16(4-2)9-11-18(12-10-16)15(13-17)14-7-5-6-8-14/h14-15H,3-13,17H2,1-2H3
InChIKeyWASXQFWZRRUSGD-UHFFFAOYSA-N
XLogP3.41
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.45
LogP ≤ 53.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine?
The IUPAC name of 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine (CID 63157458) is 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine?
The canonical SMILES for 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine is CCC1(CC)CCN(C(CN)C2CCCC2)CC1.
What is the InChIKey of 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine?
The InChIKey is WASXQFWZRRUSGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2/c1-3-16(4-2)9-11-18(12-10-16)15(13-17)14-7-5-6-8-14/h14-15H,3-13,17H2,1-2H3.
What are the key properties of 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine?
2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine has a molecular weight of 252.45 g/mol, XLogP of 3.41, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-(4,4-diethylpiperidin-1-yl)ethanamine is sourced from PubChem (CID 63157458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).