4-(3-fluoro-2-methoxyphenyl)-1H-indazole

C14H11FN2O — CID 167807069

IUPAC4-(3-fluoro-2-methoxyphenyl)-1H-indazole
SMILESCOc1c(F)cccc1-c1cccc2[nH]ncc12
InChIInChI=1S/C14H11FN2O/c1-18-14-10(5-2-6-12(14)15)9-4-3-7-13-11(9)8-16-17-13/h2-8H,1H3,(H,16,17)
InChIKeyVOPZUTQTBKOUQU-UHFFFAOYSA-N
MW242.25 g/mol
LogP3.38
Rot. Bonds2

About 4-(3-fluoro-2-methoxyphenyl)-1H-indazole

4-(3-fluoro-2-methoxyphenyl)-1H-indazole (PubChem CID 167807069) has the molecular formula C14H11FN2O and a molecular weight of 242.25 g/mol. Its IUPAC name is 4-(3-fluoro-2-methoxyphenyl)-1H-indazole.

Molecular Properties

Compound Name4-(3-fluoro-2-methoxyphenyl)-1H-indazole
PubChem CID167807069
Molecular FormulaC14H11FN2O
Molecular Weight242.25 g/mol
Exact Mass242.09
IUPAC Name4-(3-fluoro-2-methoxyphenyl)-1H-indazole
SMILESCOc1c(F)cccc1-c1cccc2[nH]ncc12
InChIInChI=1S/C14H11FN2O/c1-18-14-10(5-2-6-12(14)15)9-4-3-7-13-11(9)8-16-17-13/h2-8H,1H3,(H,16,17)
InChIKeyVOPZUTQTBKOUQU-UHFFFAOYSA-N
XLogP3.38
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.25
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1H-indazol-4-yl)-7-methoxy-1H-benzimidazole
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CID 174665708
CID 174665708
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5-(1H-indazol-4-yl)-3-methyl-1,2,4-oxadiazole
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4-(5-methyl-1H-1,2,4-triazol-3-yl)-1H-indazole
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4-(3-fluoro-2-methoxyphenyl)-1-methylpyrazol-5-amine;hydrobromide
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3-fluoro-6-(1H-indazol-4-yl)-5-methylpyridine-2-carbonitrile
CID 166395342
2-[2-(1H-indazol-4-yl)phenyl]-N,N-dimethylethanamine
CID 175730267
3-(3-fluoro-2-methoxyphenyl)-1H-1,2,4-triazole-5-carboxylic acid
CID 82376296
methyl 4-amino-3-chloro-5-fluoro-6-(1H-indazol-4-yl)pyridine-2-carboxylate
CID 90451077
3-(1H-indazol-4-yl)phenol
CID 83445848
1H-indazol-4-amine;dihydrochloride
CID 18779330

Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoro-2-methoxyphenyl)-1H-indazole?
The IUPAC name of 4-(3-fluoro-2-methoxyphenyl)-1H-indazole (CID 167807069) is 4-(3-fluoro-2-methoxyphenyl)-1H-indazole.
What is the SMILES notation for 4-(3-fluoro-2-methoxyphenyl)-1H-indazole?
The canonical SMILES for 4-(3-fluoro-2-methoxyphenyl)-1H-indazole is COc1c(F)cccc1-c1cccc2[nH]ncc12.
What is the InChIKey of 4-(3-fluoro-2-methoxyphenyl)-1H-indazole?
The InChIKey is VOPZUTQTBKOUQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O/c1-18-14-10(5-2-6-12(14)15)9-4-3-7-13-11(9)8-16-17-13/h2-8H,1H3,(H,16,17).
What are the key properties of 4-(3-fluoro-2-methoxyphenyl)-1H-indazole?
4-(3-fluoro-2-methoxyphenyl)-1H-indazole has a molecular weight of 242.25 g/mol, XLogP of 3.38, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoro-2-methoxyphenyl)-1H-indazole is sourced from PubChem (CID 167807069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).