(3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine

C13H19N5O2 — CID 102812779

IUPAC(3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine
SMILESCCc1nn(C)cc1C(N)c1ncc(OC)nc1OC
InChIInChI=1S/C13H19N5O2/c1-5-9-8(7-18(2)17-9)11(14)12-13(20-4)16-10(19-3)6-15-12/h6-7,11H,5,14H2,1-4H3
InChIKeyVHSZFSRSLLJLQK-UHFFFAOYSA-N
MW277.33 g/mol
LogP0.84
Rot. Bonds5

About (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine

(3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine (PubChem CID 102812779) has the molecular formula C13H19N5O2 and a molecular weight of 277.33 g/mol. Its IUPAC name is (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine.

Molecular Properties

Compound Name(3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine
PubChem CID102812779
Molecular FormulaC13H19N5O2
Molecular Weight277.33 g/mol
Exact Mass277.15
IUPAC Name(3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine
SMILESCCc1nn(C)cc1C(N)c1ncc(OC)nc1OC
InChIInChI=1S/C13H19N5O2/c1-5-9-8(7-18(2)17-9)11(14)12-13(20-4)16-10(19-3)6-15-12/h6-7,11H,5,14H2,1-4H3
InChIKeyVHSZFSRSLLJLQK-UHFFFAOYSA-N
XLogP0.84
TPSA88.08 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.33
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine?
The IUPAC name of (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine (CID 102812779) is (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine.
What is the SMILES notation for (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine?
The canonical SMILES for (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine is CCc1nn(C)cc1C(N)c1ncc(OC)nc1OC.
What is the InChIKey of (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine?
The InChIKey is VHSZFSRSLLJLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O2/c1-5-9-8(7-18(2)17-9)11(14)12-13(20-4)16-10(19-3)6-15-12/h6-7,11H,5,14H2,1-4H3.
What are the key properties of (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine?
(3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine has a molecular weight of 277.33 g/mol, XLogP of 0.84, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethoxypyrazin-2-yl)-(3-ethyl-1-methylpyrazol-4-yl)methanamine is sourced from PubChem (CID 102812779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).