1-(5-cyclopropylpyrazin-2-yl)ethanamine

C9H13N3 — CID 82415042

IUPAC1-(5-cyclopropylpyrazin-2-yl)ethanamine
SMILESCC(N)c1cnc(C2CC2)cn1
InChIInChI=1S/C9H13N3/c1-6(10)8-4-12-9(5-11-8)7-2-3-7/h4-7H,2-3,10H2,1H3
InChIKeyCJMYHDACRDCGGD-UHFFFAOYSA-N
MW163.22 g/mol
LogP1.37
Rot. Bonds2

About 1-(5-cyclopropylpyrazin-2-yl)ethanamine

1-(5-cyclopropylpyrazin-2-yl)ethanamine (PubChem CID 82415042) has the molecular formula C9H13N3 and a molecular weight of 163.22 g/mol. Its IUPAC name is 1-(5-cyclopropylpyrazin-2-yl)ethanamine.

Molecular Properties

Compound Name1-(5-cyclopropylpyrazin-2-yl)ethanamine
PubChem CID82415042
Molecular FormulaC9H13N3
Molecular Weight163.22 g/mol
Exact Mass163.11
IUPAC Name1-(5-cyclopropylpyrazin-2-yl)ethanamine
SMILESCC(N)c1cnc(C2CC2)cn1
InChIInChI=1S/C9H13N3/c1-6(10)8-4-12-9(5-11-8)7-2-3-7/h4-7H,2-3,10H2,1H3
InChIKeyCJMYHDACRDCGGD-UHFFFAOYSA-N
XLogP1.37
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyclopropylpyrazin-2-yl)ethanamine?
The IUPAC name of 1-(5-cyclopropylpyrazin-2-yl)ethanamine (CID 82415042) is 1-(5-cyclopropylpyrazin-2-yl)ethanamine.
What is the SMILES notation for 1-(5-cyclopropylpyrazin-2-yl)ethanamine?
The canonical SMILES for 1-(5-cyclopropylpyrazin-2-yl)ethanamine is CC(N)c1cnc(C2CC2)cn1.
What is the InChIKey of 1-(5-cyclopropylpyrazin-2-yl)ethanamine?
The InChIKey is CJMYHDACRDCGGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3/c1-6(10)8-4-12-9(5-11-8)7-2-3-7/h4-7H,2-3,10H2,1H3.
What are the key properties of 1-(5-cyclopropylpyrazin-2-yl)ethanamine?
1-(5-cyclopropylpyrazin-2-yl)ethanamine has a molecular weight of 163.22 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyclopropylpyrazin-2-yl)ethanamine is sourced from PubChem (CID 82415042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).