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

C24H24FN5O — CID 162647208

IUPAC6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine
SMILESCOc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cccc(N2CCN(C)CC2)c1
InChIInChI=1S/C24H24FN5O/c1-28-9-11-29(12-10-28)18-5-3-6-19(13-18)30-22-14-21(26-15-17(22)16-27-30)24-20(25)7-4-8-23(24)31-2/h3-8,13-16H,9-12H2,1-2H3
InChIKeyVPYIKBCWOKGXEI-UHFFFAOYSA-N
MW417.49 g/mol
LogP3.99
Rot. Bonds4

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

6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine (PubChem CID 162647208) has the molecular formula C24H24FN5O and a molecular weight of 417.49 g/mol. Its IUPAC name is 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine
PubChem CID162647208
Molecular FormulaC24H24FN5O
Molecular Weight417.49 g/mol
Exact Mass417.20
IUPAC Name6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine
SMILESCOc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cccc(N2CCN(C)CC2)c1
InChIInChI=1S/C24H24FN5O/c1-28-9-11-29(12-10-28)18-5-3-6-19(13-18)30-22-14-21(26-15-17(22)16-27-30)24-20(25)7-4-8-23(24)31-2/h3-8,13-16H,9-12H2,1-2H3
InChIKeyVPYIKBCWOKGXEI-UHFFFAOYSA-N
XLogP3.99
TPSA46.42 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500417.49
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine?
The IUPAC name of 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine (CID 162647208) is 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine?
The canonical SMILES for 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine is COc1cccc(F)c1-c1cc2c(cn1)cnn2-c1cccc(N2CCN(C)CC2)c1.
What is the InChIKey of 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine?
The InChIKey is VPYIKBCWOKGXEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN5O/c1-28-9-11-29(12-10-28)18-5-3-6-19(13-18)30-22-14-21(26-15-17(22)16-27-30)24-20(25)7-4-8-23(24)31-2/h3-8,13-16H,9-12H2,1-2H3.
What are the key properties of 6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine?
6-(2-fluoro-6-methoxyphenyl)-1-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine has a molecular weight of 417.49 g/mol, XLogP of 3.99, 4 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-[3-(4-methylpiperazin-1-yl)phenyl]pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 162647208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).