dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate

C18H15FN2O5 — CID 163390715

IUPACdimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate
SMILESCOC(=O)c1cc2c(C(=O)OC)cnn2cc1-c1c(F)cccc1OC
InChIInChI=1S/C18H15FN2O5/c1-24-15-6-4-5-13(19)16(15)12-9-21-14(7-10(12)17(22)25-2)11(8-20-21)18(23)26-3/h4-9H,1-3H3
InChIKeyQHMJKBBGAULHJC-UHFFFAOYSA-N
MW358.33 g/mol
LogP2.72
Rot. Bonds4

About dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate

dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate (PubChem CID 163390715) has the molecular formula C18H15FN2O5 and a molecular weight of 358.33 g/mol. Its IUPAC name is dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate.

Molecular Properties

Compound Namedimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate
PubChem CID163390715
Molecular FormulaC18H15FN2O5
Molecular Weight358.33 g/mol
Exact Mass358.10
IUPAC Namedimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate
SMILESCOC(=O)c1cc2c(C(=O)OC)cnn2cc1-c1c(F)cccc1OC
InChIInChI=1S/C18H15FN2O5/c1-24-15-6-4-5-13(19)16(15)12-9-21-14(7-10(12)17(22)25-2)11(8-20-21)18(23)26-3/h4-9H,1-3H3
InChIKeyQHMJKBBGAULHJC-UHFFFAOYSA-N
XLogP2.72
TPSA79.13 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.33
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

methyl 6-fluoropyrazolo[1,5-a]pyridine-3-carboxylate
CID 91825806
methyl 5-(2-fluoro-6-methoxyphenyl)pyrimidine-4-carboxylate
CID 163390834
methyl 6-methoxypyrazolo[1,5-a]pyrazine-3-carboxylate
CID 178051745
methyl 5-methylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 53399588
N-[5-[[4-[tert-butyl(dimethyl)silyl]oxycyclohexyl]methoxy]-1,3,4-thiadiazol-2-yl]-3-fluoro-6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-5-carboxamide
CID 175747267
methyl 6-alumanylpyrazolo[1,5-a]pyridine-3-carboxylate
CID 154561873
methyl 5-iodopyrazolo[1,5-a]pyridine-3-carboxylate
CID 121231756
6-cyano-4-(2-fluoro-6-methoxyphenyl)pyridine-3-carboxylic acid
CID 155342208
methyl 4-(2-chloro-6-methoxyphenyl)-6-methylpyridine-3-carboxylate
CID 166162954
1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
CID 46312197
methyl 4-cyclopropyl-5-(2-fluoro-6-methoxyphenyl)-1-(3-fluorophenyl)sulfonylpyrrole-3-carboxylate
CID 178134437
methyl 4-(2-fluoro-6-methoxyphenyl)-6-(oxan-2-yloxymethyl)pyridine-3-carboxylate
CID 155342350

Frequently Asked Questions

What is the IUPAC name of dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate?
The IUPAC name of dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate (CID 163390715) is dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate.
What is the SMILES notation for dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate?
The canonical SMILES for dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate is COC(=O)c1cc2c(C(=O)OC)cnn2cc1-c1c(F)cccc1OC.
What is the InChIKey of dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate?
The InChIKey is QHMJKBBGAULHJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O5/c1-24-15-6-4-5-13(19)16(15)12-9-21-14(7-10(12)17(22)25-2)11(8-20-21)18(23)26-3/h4-9H,1-3H3.
What are the key properties of dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate?
dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate has a molecular weight of 358.33 g/mol, XLogP of 2.72, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl 6-(2-fluoro-6-methoxyphenyl)pyrazolo[1,5-a]pyridine-3,5-dicarboxylate is sourced from PubChem (CID 163390715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).