2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine

C12H19N3 — CID 105139032

IUPAC2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine
SMILESCc1cnc(C(N)CC2CCCC2)cn1
InChIInChI=1S/C12H19N3/c1-9-7-15-12(8-14-9)11(13)6-10-4-2-3-5-10/h7-8,10-11H,2-6,13H2,1H3
InChIKeyOFLFZFQTQXYPQA-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.37
Rot. Bonds3

About 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine

2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine (PubChem CID 105139032) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine.

Molecular Properties

Compound Name2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine
PubChem CID105139032
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine
SMILESCc1cnc(C(N)CC2CCCC2)cn1
InChIInChI=1S/C12H19N3/c1-9-7-15-12(8-14-9)11(13)6-10-4-2-3-5-10/h7-8,10-11H,2-6,13H2,1H3
InChIKeyOFLFZFQTQXYPQA-UHFFFAOYSA-N
XLogP2.37
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine?
The IUPAC name of 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine (CID 105139032) is 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine.
What is the SMILES notation for 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine?
The canonical SMILES for 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine is Cc1cnc(C(N)CC2CCCC2)cn1.
What is the InChIKey of 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine?
The InChIKey is OFLFZFQTQXYPQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-9-7-15-12(8-14-9)11(13)6-10-4-2-3-5-10/h7-8,10-11H,2-6,13H2,1H3.
What are the key properties of 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine?
2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine has a molecular weight of 205.31 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-1-(5-methylpyrazin-2-yl)ethanamine is sourced from PubChem (CID 105139032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).