N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine

C12H19N3 — CID 115893473

IUPACN-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine
SMILESCC(NCCC1CCC1)c1cnccn1
InChIInChI=1S/C12H19N3/c1-10(12-9-13-7-8-15-12)14-6-5-11-3-2-4-11/h7-11,14H,2-6H2,1H3
InChIKeyLBNVARASQVNUNO-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.32
Rot. Bonds5

About N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine

N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine (PubChem CID 115893473) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine.

Molecular Properties

Compound NameN-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine
PubChem CID115893473
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC NameN-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine
SMILESCC(NCCC1CCC1)c1cnccn1
InChIInChI=1S/C12H19N3/c1-10(12-9-13-7-8-15-12)14-6-5-11-3-2-4-11/h7-11,14H,2-6H2,1H3
InChIKeyLBNVARASQVNUNO-UHFFFAOYSA-N
XLogP2.32
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine?
The IUPAC name of N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine (CID 115893473) is N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine.
What is the SMILES notation for N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine?
The canonical SMILES for N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine is CC(NCCC1CCC1)c1cnccn1.
What is the InChIKey of N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine?
The InChIKey is LBNVARASQVNUNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-10(12-9-13-7-8-15-12)14-6-5-11-3-2-4-11/h7-11,14H,2-6H2,1H3.
What are the key properties of N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine?
N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine has a molecular weight of 205.31 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclobutylethyl)-1-pyrazin-2-ylethanamine is sourced from PubChem (CID 115893473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).