[4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine

C15H30N2 — CID 103351794

IUPAC[4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine
SMILESCCC1CCN(C2CCCC2CC)C(CN)C1
InChIInChI=1S/C15H30N2/c1-3-12-8-9-17(14(10-12)11-16)15-7-5-6-13(15)4-2/h12-15H,3-11,16H2,1-2H3
InChIKeyKHZFSAVTXJSNGF-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.01
Rot. Bonds4

About [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine

[4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine (PubChem CID 103351794) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine.

Molecular Properties

Compound Name[4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine
PubChem CID103351794
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name[4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine
SMILESCCC1CCN(C2CCCC2CC)C(CN)C1
InChIInChI=1S/C15H30N2/c1-3-12-8-9-17(14(10-12)11-16)15-7-5-6-13(15)4-2/h12-15H,3-11,16H2,1-2H3
InChIKeyKHZFSAVTXJSNGF-UHFFFAOYSA-N
XLogP3.01
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine?
The IUPAC name of [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine (CID 103351794) is [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine.
What is the SMILES notation for [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine?
The canonical SMILES for [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine is CCC1CCN(C2CCCC2CC)C(CN)C1.
What is the InChIKey of [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine?
The InChIKey is KHZFSAVTXJSNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-3-12-8-9-17(14(10-12)11-16)15-7-5-6-13(15)4-2/h12-15H,3-11,16H2,1-2H3.
What are the key properties of [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine?
[4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine has a molecular weight of 238.42 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-ethyl-1-(2-ethylcyclopentyl)piperidin-2-yl]methanamine is sourced from PubChem (CID 103351794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).