2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide

C20H17N5O2 — CID 171537205

IUPAC2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide
SMILESCc1cc(-c2cncc(Oc3ccc4cnn(C)c4c3)n2)ccc1C(N)=O
InChIInChI=1S/C20H17N5O2/c1-12-7-13(4-6-16(12)20(21)26)17-10-22-11-19(24-17)27-15-5-3-14-9-23-25(2)18(14)8-15/h3-11H,1-2H3,(H2,21,26)
InChIKeyRUTVNFWRVLZIJZ-UHFFFAOYSA-N
MW359.39 g/mol
LogP3.23
Rot. Bonds4

About 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide

2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide (PubChem CID 171537205) has the molecular formula C20H17N5O2 and a molecular weight of 359.39 g/mol. Its IUPAC name is 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide.

Molecular Properties

Compound Name2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide
PubChem CID171537205
Molecular FormulaC20H17N5O2
Molecular Weight359.39 g/mol
Exact Mass359.14
IUPAC Name2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide
SMILESCc1cc(-c2cncc(Oc3ccc4cnn(C)c4c3)n2)ccc1C(N)=O
InChIInChI=1S/C20H17N5O2/c1-12-7-13(4-6-16(12)20(21)26)17-10-22-11-19(24-17)27-15-5-3-14-9-23-25(2)18(14)8-15/h3-11H,1-2H3,(H2,21,26)
InChIKeyRUTVNFWRVLZIJZ-UHFFFAOYSA-N
XLogP3.23
TPSA95.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.39
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide?
The IUPAC name of 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide (CID 171537205) is 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide.
What is the SMILES notation for 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide?
The canonical SMILES for 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide is Cc1cc(-c2cncc(Oc3ccc4cnn(C)c4c3)n2)ccc1C(N)=O.
What is the InChIKey of 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide?
The InChIKey is RUTVNFWRVLZIJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O2/c1-12-7-13(4-6-16(12)20(21)26)17-10-22-11-19(24-17)27-15-5-3-14-9-23-25(2)18(14)8-15/h3-11H,1-2H3,(H2,21,26).
What are the key properties of 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide?
2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide has a molecular weight of 359.39 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-[6-(1-methylindazol-6-yl)oxypyrazin-2-yl]benzamide is sourced from PubChem (CID 171537205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).