7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine

C19H13F2N3O2 — CID 130248885

IUPAC7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine
SMILESCOc1cccc(Oc2ccc(-c3[nH]nc4c(F)cncc34)cc2)c1F
InChIInChI=1S/C19H13F2N3O2/c1-25-15-3-2-4-16(17(15)21)26-12-7-5-11(6-8-12)18-13-9-22-10-14(20)19(13)24-23-18/h2-10H,1H3,(H,23,24)
InChIKeyOEPLRPFVLBMQOP-UHFFFAOYSA-N
MW353.33 g/mol
LogP4.70
Rot. Bonds4

About 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine

7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine (PubChem CID 130248885) has the molecular formula C19H13F2N3O2 and a molecular weight of 353.33 g/mol. Its IUPAC name is 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine
PubChem CID130248885
Molecular FormulaC19H13F2N3O2
Molecular Weight353.33 g/mol
Exact Mass353.10
IUPAC Name7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine
SMILESCOc1cccc(Oc2ccc(-c3[nH]nc4c(F)cncc34)cc2)c1F
InChIInChI=1S/C19H13F2N3O2/c1-25-15-3-2-4-16(17(15)21)26-12-7-5-11(6-8-12)18-13-9-22-10-14(20)19(13)24-23-18/h2-10H,1H3,(H,23,24)
InChIKeyOEPLRPFVLBMQOP-UHFFFAOYSA-N
XLogP4.70
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.33
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine (CID 130248885) is 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine is COc1cccc(Oc2ccc(-c3[nH]nc4c(F)cncc34)cc2)c1F.
What is the InChIKey of 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine?
The InChIKey is OEPLRPFVLBMQOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F2N3O2/c1-25-15-3-2-4-16(17(15)21)26-12-7-5-11(6-8-12)18-13-9-22-10-14(20)19(13)24-23-18/h2-10H,1H3,(H,23,24).
What are the key properties of 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine?
7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine has a molecular weight of 353.33 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-3-[4-(2-fluoro-3-methoxyphenoxy)phenyl]-2H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 130248885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).