5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide

C13H12FN5O2 — CID 166371381

IUPAC5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide
SMILESCOc1nn(C)cc1NC(=O)c1n[nH]c2ccc(F)cc12
InChIInChI=1S/C13H12FN5O2/c1-19-6-10(13(18-19)21-2)15-12(20)11-8-5-7(14)3-4-9(8)16-17-11/h3-6H,1-2H3,(H,15,20)(H,16,17)
InChIKeyGRVHJDFAWFWWHK-UHFFFAOYSA-N
MW289.27 g/mol
LogP1.70
Rot. Bonds3

About 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide

5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide (PubChem CID 166371381) has the molecular formula C13H12FN5O2 and a molecular weight of 289.27 g/mol. Its IUPAC name is 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide
PubChem CID166371381
Molecular FormulaC13H12FN5O2
Molecular Weight289.27 g/mol
Exact Mass289.10
IUPAC Name5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide
SMILESCOc1nn(C)cc1NC(=O)c1n[nH]c2ccc(F)cc12
InChIInChI=1S/C13H12FN5O2/c1-19-6-10(13(18-19)21-2)15-12(20)11-8-5-7(14)3-4-9(8)16-17-11/h3-6H,1-2H3,(H,15,20)(H,16,17)
InChIKeyGRVHJDFAWFWWHK-UHFFFAOYSA-N
XLogP1.70
TPSA84.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.27
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-N-(1,3-dimethylpyrazol-4-yl)-1H-indazole-3-carboxamide
CID 102803191
5-fluoro-N-methyl-1H-indazole-3-carboxamide
CID 110469324
5-amino-N-(5-fluoro-2-methylphenyl)-1H-indazole-3-carboxamide
CID 60904758
1-[3-(2,4-difluorophenyl)cyclobutyl]-3-(3-methoxy-1-methylpyrazol-4-yl)urea
CID 136585643
3-acetyl-6-fluoro-1H-cinnolin-4-one
CID 39733177
N-(5-chloro-2-fluorophenyl)-1H-indazole-3-carboxamide
CID 60700965
5-methyl-N-(2-methylphenyl)-1H-indazole-3-carboxamide
CID 78859031
4-amino-N-(5-chloro-2-fluorophenyl)-1-methylpyrazole-3-carboxamide
CID 65355117
(2R)-2-bromo-N-(3-methoxy-1-methylpyrazol-4-yl)propanamide
CID 129452314
5-[[1-(4-fluoro-2-methylphenyl)-4-hydroxypyrazole-3-carbonyl]amino]-1H-indazole-3-carboxylic acid
CID 167802563
2-amino-3-[3-[(5-fluoro-1H-indazole-3-carbonyl)amino]phenyl]propanoic acid
CID 167989101
5-fluoro-2-methoxy-N-(1-methyl-3-pyridin-2-ylpyrazol-4-yl)benzamide
CID 167847189

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide (CID 166371381) is 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide is COc1nn(C)cc1NC(=O)c1n[nH]c2ccc(F)cc12.
What is the InChIKey of 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide?
The InChIKey is GRVHJDFAWFWWHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FN5O2/c1-19-6-10(13(18-19)21-2)15-12(20)11-8-5-7(14)3-4-9(8)16-17-11/h3-6H,1-2H3,(H,15,20)(H,16,17).
What are the key properties of 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide?
5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide has a molecular weight of 289.27 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-(3-methoxy-1-methylpyrazol-4-yl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 166371381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).