6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine

C17H14FN5O — CID 162676880

IUPAC6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine
SMILESCOc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cnn(C)c1
InChIInChI=1S/C17H14FN5O/c1-22-10-12(9-20-22)23-15-6-14(19-7-11(15)8-21-23)17-13(18)4-3-5-16(17)24-2/h3-10H,1-2H3
InChIKeyBCRKGTUDXOAFOG-UHFFFAOYSA-N
MW323.33 g/mol
LogP2.97
Rot. Bonds3

About 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine

6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine (PubChem CID 162676880) has the molecular formula C17H14FN5O and a molecular weight of 323.33 g/mol. Its IUPAC name is 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine
PubChem CID162676880
Molecular FormulaC17H14FN5O
Molecular Weight323.33 g/mol
Exact Mass323.12
IUPAC Name6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine
SMILESCOc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cnn(C)c1
InChIInChI=1S/C17H14FN5O/c1-22-10-12(9-20-22)23-15-6-14(19-7-11(15)8-21-23)17-13(18)4-3-5-16(17)24-2/h3-10H,1-2H3
InChIKeyBCRKGTUDXOAFOG-UHFFFAOYSA-N
XLogP2.97
TPSA57.76 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.33
LogP ≤ 52.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine?
The IUPAC name of 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine (CID 162676880) is 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine?
The canonical SMILES for 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine is COc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cnn(C)c1.
What is the InChIKey of 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine?
The InChIKey is BCRKGTUDXOAFOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN5O/c1-22-10-12(9-20-22)23-15-6-14(19-7-11(15)8-21-23)17-13(18)4-3-5-16(17)24-2/h3-10H,1-2H3.
What are the key properties of 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine?
6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine has a molecular weight of 323.33 g/mol, XLogP of 2.97, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-6-methoxyphenyl)-1-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 162676880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).