4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide

C23H22FN7O3 — CID 46911123

IUPAC4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide
SMILESCCn1cc2c(Oc3cnc(C(=O)N(C)C)c(F)c3)cc(C(=O)Nc3cnc(C)cn3)cc2n1
InChIInChI=1S/C23H22FN7O3/c1-5-31-12-16-18(29-31)6-14(22(32)28-20-11-25-13(2)9-26-20)7-19(16)34-15-8-17(24)21(27-10-15)23(33)30(3)4/h6-12H,5H2,1-4H3,(H,26,28,32)
InChIKeyYUOWWGGXVKBXNS-UHFFFAOYSA-N
MW463.47 g/mol
LogP3.44
Rot. Bonds6

About 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide

4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide (PubChem CID 46911123) has the molecular formula C23H22FN7O3 and a molecular weight of 463.47 g/mol. Its IUPAC name is 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide.

Molecular Properties

Compound Name4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide
PubChem CID46911123
Molecular FormulaC23H22FN7O3
Molecular Weight463.47 g/mol
Exact Mass463.18
IUPAC Name4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide
SMILESCCn1cc2c(Oc3cnc(C(=O)N(C)C)c(F)c3)cc(C(=O)Nc3cnc(C)cn3)cc2n1
InChIInChI=1S/C23H22FN7O3/c1-5-31-12-16-18(29-31)6-14(22(32)28-20-11-25-13(2)9-26-20)7-19(16)34-15-8-17(24)21(27-10-15)23(33)30(3)4/h6-12H,5H2,1-4H3,(H,26,28,32)
InChIKeyYUOWWGGXVKBXNS-UHFFFAOYSA-N
XLogP3.44
TPSA115.13 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500463.47
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

2-ethyl-N-(5-methylpyrazin-2-yl)-4-(4-sulfamoylphenoxy)indazole-6-carboxamide
CID 58574099
4-[4-(dimethylsulfamoyl)phenoxy]-2-methyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide
CID 71457592
4-(5-carbamoylpyrazin-2-yl)oxy-2-ethyl-N-(5-methyl-2-pyridinyl)indazole-6-carboxamide
CID 58574075
ethyl 2-ethyl-4-[5-(methanesulfonamido)pyrazin-2-yl]oxyindazole-6-carboxylate
CID 58574041
2-methyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide
CID 67997917
4-(5-aminopyrazin-2-yl)oxy-2-ethylindazole-6-carboxylic acid
CID 123170198
3-chloro-N,N-dimethyl-4-[3-[(3S)-1-methyl-2-oxopyrrolidin-3-yl]oxy-5-[(5-methylpyrazin-2-yl)carbamoyl]phenoxy]benzamide
CID 24953715
ethyl 2-ethyl-4-[5-[methyl(methylsulfonyl)amino]pyrazin-2-yl]oxyindazole-6-carboxylate
CID 58574101
4-amino-3-fluoro-N-(5-methylpyrazin-2-yl)benzamide
CID 162519877
2-methyl-N-(5-methylpyrazin-2-yl)-4-(4-methylsulfonylphenoxy)-1-benzofuran-6-carboxamide
CID 90665737
4-[4-(dimethylcarbamoyl)-3-fluorophenoxy]-N-(1-methylpyrazol-3-yl)-1-benzothiophene-6-carboxamide
CID 59560107
2-N,2-N-dimethyl-4-(4-methylphenoxy)-6-N-(2-methyltriazol-4-yl)-1-benzofuran-2,6-dicarboxamide;sulfur dioxide
CID 158269151

Frequently Asked Questions

What is the IUPAC name of 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide?
The IUPAC name of 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide (CID 46911123) is 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide.
What is the SMILES notation for 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide?
The canonical SMILES for 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide is CCn1cc2c(Oc3cnc(C(=O)N(C)C)c(F)c3)cc(C(=O)Nc3cnc(C)cn3)cc2n1.
What is the InChIKey of 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide?
The InChIKey is YUOWWGGXVKBXNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22FN7O3/c1-5-31-12-16-18(29-31)6-14(22(32)28-20-11-25-13(2)9-26-20)7-19(16)34-15-8-17(24)21(27-10-15)23(33)30(3)4/h6-12H,5H2,1-4H3,(H,26,28,32).
What are the key properties of 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide?
4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide has a molecular weight of 463.47 g/mol, XLogP of 3.44, 6 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[6-(dimethylcarbamoyl)-5-fluoro-3-pyridinyl]oxy]-2-ethyl-N-(5-methylpyrazin-2-yl)indazole-6-carboxamide is sourced from PubChem (CID 46911123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).