2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide

C19H14F3N7O2 — CID 46909917

IUPAC2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide
SMILESCc1cnc(NC(=O)c2cc(Oc3cnc(C(F)(F)F)cn3)c3cn(C)nc3c2)cn1
InChIInChI=1S/C19H14F3N7O2/c1-10-5-25-16(7-23-10)27-18(30)11-3-13-12(9-29(2)28-13)14(4-11)31-17-8-24-15(6-26-17)19(20,21)22/h3-9H,1-2H3,(H,25,27,30)
InChIKeyBTRKGESFNGVHJA-UHFFFAOYSA-N
MW429.36 g/mol
LogP3.53
Rot. Bonds4

About 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide

2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide (PubChem CID 46909917) has the molecular formula C19H14F3N7O2 and a molecular weight of 429.36 g/mol. Its IUPAC name is 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide.

Molecular Properties

Compound Name2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide
PubChem CID46909917
Molecular FormulaC19H14F3N7O2
Molecular Weight429.36 g/mol
Exact Mass429.12
IUPAC Name2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide
SMILESCc1cnc(NC(=O)c2cc(Oc3cnc(C(F)(F)F)cn3)c3cn(C)nc3c2)cn1
InChIInChI=1S/C19H14F3N7O2/c1-10-5-25-16(7-23-10)27-18(30)11-3-13-12(9-29(2)28-13)14(4-11)31-17-8-24-15(6-26-17)19(20,21)22/h3-9H,1-2H3,(H,25,27,30)
InChIKeyBTRKGESFNGVHJA-UHFFFAOYSA-N
XLogP3.53
TPSA107.71 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.36
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide?
The IUPAC name of 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide (CID 46909917) is 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide.
What is the SMILES notation for 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide?
The canonical SMILES for 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide is Cc1cnc(NC(=O)c2cc(Oc3cnc(C(F)(F)F)cn3)c3cn(C)nc3c2)cn1.
What is the InChIKey of 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide?
The InChIKey is BTRKGESFNGVHJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N7O2/c1-10-5-25-16(7-23-10)27-18(30)11-3-13-12(9-29(2)28-13)14(4-11)31-17-8-24-15(6-26-17)19(20,21)22/h3-9H,1-2H3,(H,25,27,30).
What are the key properties of 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide?
2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide has a molecular weight of 429.36 g/mol, XLogP of 3.53, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(5-methylpyrazin-2-yl)-4-[5-(trifluoromethyl)pyrazin-2-yl]oxyindazole-6-carboxamide is sourced from PubChem (CID 46909917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).