3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide

C12H12N4O2 — CID 10332062

IUPAC3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide
SMILESCNC(=O)c1nc(-c2cccc(O)c2)cnc1N
InChIInChI=1S/C12H12N4O2/c1-14-12(18)10-11(13)15-6-9(16-10)7-3-2-4-8(17)5-7/h2-6,17H,1H3,(H2,13,15)(H,14,18)
InChIKeyPDXCPAWFKAPISK-UHFFFAOYSA-N
MW244.25 g/mol
LogP0.79
Rot. Bonds2

About 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide

3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide (PubChem CID 10332062) has the molecular formula C12H12N4O2 and a molecular weight of 244.25 g/mol. Its IUPAC name is 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide
PubChem CID10332062
Molecular FormulaC12H12N4O2
Molecular Weight244.25 g/mol
Exact Mass244.10
IUPAC Name3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide
SMILESCNC(=O)c1nc(-c2cccc(O)c2)cnc1N
InChIInChI=1S/C12H12N4O2/c1-14-12(18)10-11(13)15-6-9(16-10)7-3-2-4-8(17)5-7/h2-6,17H,1H3,(H2,13,15)(H,14,18)
InChIKeyPDXCPAWFKAPISK-UHFFFAOYSA-N
XLogP0.79
TPSA101.13 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 50.79
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 3-amino-6-(3-hydroxyphenyl)-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-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide?
The IUPAC name of 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide (CID 10332062) is 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide?
The canonical SMILES for 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide is CNC(=O)c1nc(-c2cccc(O)c2)cnc1N.
What is the InChIKey of 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide?
The InChIKey is PDXCPAWFKAPISK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2/c1-14-12(18)10-11(13)15-6-9(16-10)7-3-2-4-8(17)5-7/h2-6,17H,1H3,(H2,13,15)(H,14,18).
What are the key properties of 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide?
3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide has a molecular weight of 244.25 g/mol, XLogP of 0.79, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(3-hydroxyphenyl)-N-methylpyrazine-2-carboxamide is sourced from PubChem (CID 10332062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).