N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide

C14H14N6O2 — CID 66499445

IUPACN-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide
SMILESCOc1ccccc1NC(=O)c1nnc2nc(C)nn2c1C
InChIInChI=1S/C14H14N6O2/c1-8-12(17-18-14-15-9(2)19-20(8)14)13(21)16-10-6-4-5-7-11(10)22-3/h4-7H,1-3H3,(H,16,21)
InChIKeyLOKFMTADGJAOGR-UHFFFAOYSA-N
MW298.31 g/mol
LogP1.40
Rot. Bonds3

About N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide

N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide (PubChem CID 66499445) has the molecular formula C14H14N6O2 and a molecular weight of 298.31 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide
PubChem CID66499445
Molecular FormulaC14H14N6O2
Molecular Weight298.31 g/mol
Exact Mass298.12
IUPAC NameN-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide
SMILESCOc1ccccc1NC(=O)c1nnc2nc(C)nn2c1C
InChIInChI=1S/C14H14N6O2/c1-8-12(17-18-14-15-9(2)19-20(8)14)13(21)16-10-6-4-5-7-11(10)22-3/h4-7H,1-3H3,(H,16,21)
InChIKeyLOKFMTADGJAOGR-UHFFFAOYSA-N
XLogP1.40
TPSA94.30 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.31
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide with MolForge

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Related Compounds

7-ethyl-N-(2-methoxyphenyl)-4-methyl-8-phenylpyrazolo[5,1-c][1,2,4]triazine-3-carboxamide
CID 17228388
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CID 122175613
N-(2-methoxyphenyl)-5-methyl-2H-triazole-4-carboxamide
CID 110691757
N-(2-ethoxyphenyl)-7-(methoxymethyl)-8-(4-methoxyphenyl)-4-methylpyrazolo[5,1-c][1,2,4]triazine-3-carboxamide
CID 43864222
6,7-difluoro-N-(2-methoxyphenyl)-3-methylquinoxaline-2-carboxamide
CID 23963431
1-[2-(2-ethoxyanilino)-2-oxoethyl]-N-(2-methoxyphenyl)-5-methyltriazole-4-carboxamide
CID 53366120
N-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
CID 16585086
(7-ethyl-4-methyl-[1,2,4]triazolo[5,1-c][1,2,4]triazin-3-yl)-(2-methoxyphenyl)methanone
CID 66499320
N-(2-methoxyphenyl)-5-methyl-1-(4-propan-2-ylphenyl)triazole-4-carboxamide
CID 7245475
N-(2-methoxyphenyl)-1-methylindazole-3-carboxamide
CID 110859879
1-[2-(3-chloro-4-methylanilino)-2-oxoethyl]-N-(2-methoxyphenyl)-5-methyltriazole-4-carboxamide
CID 53335252
2-bromo-N-(2-methoxyphenyl)benzamide
CID 676344

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide?
The IUPAC name of N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide (CID 66499445) is N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide.
What is the SMILES notation for N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide?
The canonical SMILES for N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide is COc1ccccc1NC(=O)c1nnc2nc(C)nn2c1C.
What is the InChIKey of N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide?
The InChIKey is LOKFMTADGJAOGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N6O2/c1-8-12(17-18-14-15-9(2)19-20(8)14)13(21)16-10-6-4-5-7-11(10)22-3/h4-7H,1-3H3,(H,16,21).
What are the key properties of N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide?
N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide has a molecular weight of 298.31 g/mol, XLogP of 1.40, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-4,7-dimethyl-[1,2,4]triazolo[5,1-c][1,2,4]triazine-3-carboxamide is sourced from PubChem (CID 66499445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).