4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide

C20H18N6O2 — CID 1493016

IUPAC4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2nnc3cc(-c4ccc(C)cc4)nn3c2N)cc1
InChIInChI=1S/C20H18N6O2/c1-12-3-5-13(6-4-12)16-11-17-23-24-18(19(21)26(17)25-16)20(27)22-14-7-9-15(28-2)10-8-14/h3-11H,21H2,1-2H3,(H,22,27)
InChIKeyCSOPXAPPBZRCBN-UHFFFAOYSA-N
MW374.40 g/mol
LogP2.94
Rot. Bonds4

About 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide

4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide (PubChem CID 1493016) has the molecular formula C20H18N6O2 and a molecular weight of 374.40 g/mol. Its IUPAC name is 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide
PubChem CID1493016
Molecular FormulaC20H18N6O2
Molecular Weight374.40 g/mol
Exact Mass374.15
IUPAC Name4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2nnc3cc(-c4ccc(C)cc4)nn3c2N)cc1
InChIInChI=1S/C20H18N6O2/c1-12-3-5-13(6-4-12)16-11-17-23-24-18(19(21)26(17)25-16)20(27)22-14-7-9-15(28-2)10-8-14/h3-11H,21H2,1-2H3,(H,22,27)
InChIKeyCSOPXAPPBZRCBN-UHFFFAOYSA-N
XLogP2.94
TPSA107.43 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.40
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

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Related Compounds

4-amino-N-(4-chlorophenyl)-7-phenylpyrazolo[5,1-c][1,2,4]triazine-3-carboxamide
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N-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)-7-methyl-4-oxopyrazolo[1,5-d][1,2,4]triazin-5-yl]acetamide
CID 20953754
2-(4-acetamidophenyl)-N-(4-methoxyphenyl)-6-methylquinoline-4-carboxamide
CID 46375324
1-[4-ethyl-7-(4-methoxyphenyl)pyrazolo[5,1-c][1,2,4]triazin-3-yl]propan-1-one
CID 13011546
7-methoxy-N-(4-methylphenyl)-2-phenylquinoline-4-carboxamide
CID 164616063
N-(4-methoxyphenyl)-1,4-dimethylpyrazole-3-carboxamide
CID 110860027
5-amino-1-[2-(4-methylanilino)-2-oxoethyl]-N-(4-methylphenyl)triazole-4-carboxamide
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5-amino-N-(4-ethoxyphenyl)-1-[2-(4-methoxyanilino)-2-oxoethyl]triazole-4-carboxamide
CID 20853622
1-[2-(4-methoxyphenyl)-5-methylpyrazolo[1,5-a]pyrimidin-7-yl]-N-(4-methylphenyl)piperidine-4-carboxamide
CID 50821900
2-(4-methoxyphenyl)-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]quinoline-4-carboxamide
CID 3672707
N-(4-methoxyphenyl)-2-phenylquinoline-4-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide?
The IUPAC name of 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide (CID 1493016) is 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide.
What is the SMILES notation for 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide?
The canonical SMILES for 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide is COc1ccc(NC(=O)c2nnc3cc(-c4ccc(C)cc4)nn3c2N)cc1.
What is the InChIKey of 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide?
The InChIKey is CSOPXAPPBZRCBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N6O2/c1-12-3-5-13(6-4-12)16-11-17-23-24-18(19(21)26(17)25-16)20(27)22-14-7-9-15(28-2)10-8-14/h3-11H,21H2,1-2H3,(H,22,27).
What are the key properties of 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide?
4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide has a molecular weight of 374.40 g/mol, XLogP of 2.94, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-methoxyphenyl)-7-(4-methylphenyl)pyrazolo[5,1-c][1,2,4]triazine-3-carboxamide is sourced from PubChem (CID 1493016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).