3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide

C14H16N4O2 — CID 10084620

IUPAC3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide
SMILESCCOc1ccc(-c2cnc(N)c(C(=O)NC)n2)cc1
InChIInChI=1S/C14H16N4O2/c1-3-20-10-6-4-9(5-7-10)11-8-17-13(15)12(18-11)14(19)16-2/h4-8H,3H2,1-2H3,(H2,15,17)(H,16,19)
InChIKeyCZBSBXHVDCDFCG-UHFFFAOYSA-N
MW272.31 g/mol
LogP1.48
Rot. Bonds4

About 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide

3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide (PubChem CID 10084620) has the molecular formula C14H16N4O2 and a molecular weight of 272.31 g/mol. Its IUPAC name is 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide
PubChem CID10084620
Molecular FormulaC14H16N4O2
Molecular Weight272.31 g/mol
Exact Mass272.13
IUPAC Name3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide
SMILESCCOc1ccc(-c2cnc(N)c(C(=O)NC)n2)cc1
InChIInChI=1S/C14H16N4O2/c1-3-20-10-6-4-9(5-7-10)11-8-17-13(15)12(18-11)14(19)16-2/h4-8H,3H2,1-2H3,(H2,15,17)(H,16,19)
InChIKeyCZBSBXHVDCDFCG-UHFFFAOYSA-N
XLogP1.48
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.31
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide 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-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide?
The IUPAC name of 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide (CID 10084620) is 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide?
The canonical SMILES for 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide is CCOc1ccc(-c2cnc(N)c(C(=O)NC)n2)cc1.
What is the InChIKey of 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide?
The InChIKey is CZBSBXHVDCDFCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O2/c1-3-20-10-6-4-9(5-7-10)11-8-17-13(15)12(18-11)14(19)16-2/h4-8H,3H2,1-2H3,(H2,15,17)(H,16,19).
What are the key properties of 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide?
3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide has a molecular weight of 272.31 g/mol, XLogP of 1.48, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(4-ethoxyphenyl)-N-methylpyrazine-2-carboxamide is sourced from PubChem (CID 10084620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).