2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine

C15H20N4 — CID 106738459

IUPAC2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine
SMILESNCC(C1CCCC1)n1cncc1-c1cccnc1
InChIInChI=1S/C15H20N4/c16-8-14(12-4-1-2-5-12)19-11-18-10-15(19)13-6-3-7-17-9-13/h3,6-7,9-12,14H,1-2,4-5,8,16H2
InChIKeyAXXYNNYHKGXDOX-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.64
Rot. Bonds4

About 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine

2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine (PubChem CID 106738459) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine
PubChem CID106738459
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine
SMILESNCC(C1CCCC1)n1cncc1-c1cccnc1
InChIInChI=1S/C15H20N4/c16-8-14(12-4-1-2-5-12)19-11-18-10-15(19)13-6-3-7-17-9-13/h3,6-7,9-12,14H,1-2,4-5,8,16H2
InChIKeyAXXYNNYHKGXDOX-UHFFFAOYSA-N
XLogP2.64
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine?
The IUPAC name of 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine (CID 106738459) is 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine?
The canonical SMILES for 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine is NCC(C1CCCC1)n1cncc1-c1cccnc1.
What is the InChIKey of 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine?
The InChIKey is AXXYNNYHKGXDOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c16-8-14(12-4-1-2-5-12)19-11-18-10-15(19)13-6-3-7-17-9-13/h3,6-7,9-12,14H,1-2,4-5,8,16H2.
What are the key properties of 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine?
2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine has a molecular weight of 256.35 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-(5-pyridin-3-ylimidazol-1-yl)ethanamine is sourced from PubChem (CID 106738459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).