6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine

C19H13F3N4O — CID 155389260

IUPAC6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
SMILESFc1cncc(Cn2ncc3ncc(-c4cccc(OC(F)F)c4)cc32)c1
InChIInChI=1S/C19H13F3N4O/c20-15-4-12(7-23-9-15)11-26-18-6-14(8-24-17(18)10-25-26)13-2-1-3-16(5-13)27-19(21)22/h1-10,19H,11H2
InChIKeyRQKBHNRLEQPRLU-UHFFFAOYSA-N
MW370.33 g/mol
LogP4.28
Rot. Bonds5

About 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine

6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine (PubChem CID 155389260) has the molecular formula C19H13F3N4O and a molecular weight of 370.33 g/mol. Its IUPAC name is 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
PubChem CID155389260
Molecular FormulaC19H13F3N4O
Molecular Weight370.33 g/mol
Exact Mass370.10
IUPAC Name6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
SMILESFc1cncc(Cn2ncc3ncc(-c4cccc(OC(F)F)c4)cc32)c1
InChIInChI=1S/C19H13F3N4O/c20-15-4-12(7-23-9-15)11-26-18-6-14(8-24-17(18)10-25-26)13-2-1-3-16(5-13)27-19(21)22/h1-10,19H,11H2
InChIKeyRQKBHNRLEQPRLU-UHFFFAOYSA-N
XLogP4.28
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.33
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]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-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The IUPAC name of 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine (CID 155389260) is 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The canonical SMILES for 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine is Fc1cncc(Cn2ncc3ncc(-c4cccc(OC(F)F)c4)cc32)c1.
What is the InChIKey of 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The InChIKey is RQKBHNRLEQPRLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F3N4O/c20-15-4-12(7-23-9-15)11-26-18-6-14(8-24-17(18)10-25-26)13-2-1-3-16(5-13)27-19(21)22/h1-10,19H,11H2.
What are the key properties of 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine has a molecular weight of 370.33 g/mol, XLogP of 4.28, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(difluoromethoxy)phenyl]-1-[(5-fluoro-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 155389260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).