1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine

C11H15N5 — CID 105114103

IUPAC1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine
SMILESCc1cnc(C(N)Cc2cnn(C)c2)cn1
InChIInChI=1S/C11H15N5/c1-8-4-14-11(6-13-8)10(12)3-9-5-15-16(2)7-9/h4-7,10H,3,12H2,1-2H3
InChIKeyMYHFGIRNLZMCEQ-UHFFFAOYSA-N
MW217.28 g/mol
LogP0.76
Rot. Bonds3

About 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine

1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine (PubChem CID 105114103) has the molecular formula C11H15N5 and a molecular weight of 217.28 g/mol. Its IUPAC name is 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine.

Molecular Properties

Compound Name1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine
PubChem CID105114103
Molecular FormulaC11H15N5
Molecular Weight217.28 g/mol
Exact Mass217.13
IUPAC Name1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine
SMILESCc1cnc(C(N)Cc2cnn(C)c2)cn1
InChIInChI=1S/C11H15N5/c1-8-4-14-11(6-13-8)10(12)3-9-5-15-16(2)7-9/h4-7,10H,3,12H2,1-2H3
InChIKeyMYHFGIRNLZMCEQ-UHFFFAOYSA-N
XLogP0.76
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.28
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The IUPAC name of 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine (CID 105114103) is 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine.
What is the SMILES notation for 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The canonical SMILES for 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine is Cc1cnc(C(N)Cc2cnn(C)c2)cn1.
What is the InChIKey of 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
The InChIKey is MYHFGIRNLZMCEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5/c1-8-4-14-11(6-13-8)10(12)3-9-5-15-16(2)7-9/h4-7,10H,3,12H2,1-2H3.
What are the key properties of 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine?
1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine has a molecular weight of 217.28 g/mol, XLogP of 0.76, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-methylpyrazin-2-yl)-2-(1-methylpyrazol-4-yl)ethanamine is sourced from PubChem (CID 105114103), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).