2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole

C15H12ClFN2O2 — CID 153368100

IUPAC2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole
SMILESCOc1ccc(-n2nc3ccc(OC)cc3c2F)c(Cl)c1
InChIInChI=1S/C15H12ClFN2O2/c1-20-9-3-5-13-11(7-9)15(17)19(18-13)14-6-4-10(21-2)8-12(14)16/h3-8H,1-2H3
InChIKeyUZURHWWIPILRGG-UHFFFAOYSA-N
MW306.72 g/mol
LogP3.84
Rot. Bonds3

About 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole

2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole (PubChem CID 153368100) has the molecular formula C15H12ClFN2O2 and a molecular weight of 306.72 g/mol. Its IUPAC name is 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole.

Molecular Properties

Compound Name2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole
PubChem CID153368100
Molecular FormulaC15H12ClFN2O2
Molecular Weight306.72 g/mol
Exact Mass306.06
IUPAC Name2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole
SMILESCOc1ccc(-n2nc3ccc(OC)cc3c2F)c(Cl)c1
InChIInChI=1S/C15H12ClFN2O2/c1-20-9-3-5-13-11(7-9)15(17)19(18-13)14-6-4-10(21-2)8-12(14)16/h3-8H,1-2H3
InChIKeyUZURHWWIPILRGG-UHFFFAOYSA-N
XLogP3.84
TPSA36.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.72
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

sodium 2-chloro-4-methoxyphenolate
CID 23710122
[3-bromo-2-(4-methoxy-2-methylphenyl)indazol-5-yl] acetate
CID 150177461
acetaldehyde;3-iodo-2-(4-methoxy-2-methylphenyl)indazol-5-ol
CID 158558109
5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methoxy-3-methylpyrazole
CID 66839207
3-[2-[2-(diethylamino)-5-methoxyindazol-3-yl]ethynyl]-N,N-diethyl-5-methoxyindazol-2-amine
CID 101400139
4-fluoro-6-methoxy-3H-quinazolin-2-one
CID 70521421
3-(1,3-dithiolan-2-yl)-5-methoxy-2-(4-methoxyphenyl)indazole
CID 153368089
2-(2-chlorophenyl)-5-methoxyindazole
CID 102305740
2-chloro-4-methoxy-1-methylbenzene
CID 6951757
4-chloro-6-methoxyquinoline-3-carbonitrile
CID 87839135
4-chloro-6-methoxycinnoline-3-carboxylic acid
CID 83898135
4-chloro-6-methoxycinnoline-3-carbonitrile
CID 83889129

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole?
The IUPAC name of 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole (CID 153368100) is 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole.
What is the SMILES notation for 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole?
The canonical SMILES for 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole is COc1ccc(-n2nc3ccc(OC)cc3c2F)c(Cl)c1.
What is the InChIKey of 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole?
The InChIKey is UZURHWWIPILRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClFN2O2/c1-20-9-3-5-13-11(7-9)15(17)19(18-13)14-6-4-10(21-2)8-12(14)16/h3-8H,1-2H3.
What are the key properties of 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole?
2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole has a molecular weight of 306.72 g/mol, XLogP of 3.84, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methoxyphenyl)-3-fluoro-5-methoxyindazole is sourced from PubChem (CID 153368100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).