N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine

C18H30N2 — CID 105014613

IUPACN-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine
SMILESCCNC(Cc1ccc(CC)cn1)C1(CC)CCCC1
InChIInChI=1S/C18H30N2/c1-4-15-9-10-16(20-14-15)13-17(19-6-3)18(5-2)11-7-8-12-18/h9-10,14,17,19H,4-8,11-13H2,1-3H3
InChIKeyHFAGBTYDLHNGLW-UHFFFAOYSA-N
MW274.45 g/mol
LogP4.14
Rot. Bonds7

About N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine

N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine (PubChem CID 105014613) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound NameN-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine
PubChem CID105014613
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC NameN-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine
SMILESCCNC(Cc1ccc(CC)cn1)C1(CC)CCCC1
InChIInChI=1S/C18H30N2/c1-4-15-9-10-16(20-14-15)13-17(19-6-3)18(5-2)11-7-8-12-18/h9-10,14,17,19H,4-8,11-13H2,1-3H3
InChIKeyHFAGBTYDLHNGLW-UHFFFAOYSA-N
XLogP4.14
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine?
The IUPAC name of N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine (CID 105014613) is N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine.
What is the SMILES notation for N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine?
The canonical SMILES for N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine is CCNC(Cc1ccc(CC)cn1)C1(CC)CCCC1.
What is the InChIKey of N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine?
The InChIKey is HFAGBTYDLHNGLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-4-15-9-10-16(20-14-15)13-17(19-6-3)18(5-2)11-7-8-12-18/h9-10,14,17,19H,4-8,11-13H2,1-3H3.
What are the key properties of N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine?
N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine has a molecular weight of 274.45 g/mol, XLogP of 4.14, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-(1-ethylcyclopentyl)-2-(5-ethyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 105014613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).