N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine

C15H30N2 — CID 55087537

IUPACN-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine
SMILESCCC1CCN(CCCNC2CCCC2)CC1
InChIInChI=1S/C15H30N2/c1-2-14-8-12-17(13-9-14)11-5-10-16-15-6-3-4-7-15/h14-16H,2-13H2,1H3
InChIKeyJQBDDNCLBVLLMX-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.03
Rot. Bonds6

About N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine

N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine (PubChem CID 55087537) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine.

Molecular Properties

Compound NameN-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine
PubChem CID55087537
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC NameN-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine
SMILESCCC1CCN(CCCNC2CCCC2)CC1
InChIInChI=1S/C15H30N2/c1-2-14-8-12-17(13-9-14)11-5-10-16-15-6-3-4-7-15/h14-16H,2-13H2,1H3
InChIKeyJQBDDNCLBVLLMX-UHFFFAOYSA-N
XLogP3.03
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.03
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 N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine?
The IUPAC name of N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine (CID 55087537) is N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine.
What is the SMILES notation for N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine?
The canonical SMILES for N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine is CCC1CCN(CCCNC2CCCC2)CC1.
What is the InChIKey of N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine?
The InChIKey is JQBDDNCLBVLLMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-2-14-8-12-17(13-9-14)11-5-10-16-15-6-3-4-7-15/h14-16H,2-13H2,1H3.
What are the key properties of N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine?
N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine has a molecular weight of 238.42 g/mol, XLogP of 3.03, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-ethylpiperidin-1-yl)propyl]cyclopentanamine is sourced from PubChem (CID 55087537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).