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

C19H14F2N4 — CID 155388780

IUPAC6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
SMILESCc1ccncc1Cn1ncc2ncc(-c3ccc(F)c(F)c3)cc21
InChIInChI=1S/C19H14F2N4/c1-12-4-5-22-8-15(12)11-25-19-7-14(9-23-18(19)10-24-25)13-2-3-16(20)17(21)6-13/h2-10H,11H2,1H3
InChIKeyOYNWPGCXTBFTGS-UHFFFAOYSA-N
MW336.35 g/mol
LogP4.13
Rot. Bonds3

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

6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine (PubChem CID 155388780) has the molecular formula C19H14F2N4 and a molecular weight of 336.35 g/mol. Its IUPAC name is 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
PubChem CID155388780
Molecular FormulaC19H14F2N4
Molecular Weight336.35 g/mol
Exact Mass336.12
IUPAC Name6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
SMILESCc1ccncc1Cn1ncc2ncc(-c3ccc(F)c(F)c3)cc21
InChIInChI=1S/C19H14F2N4/c1-12-4-5-22-8-15(12)11-25-19-7-14(9-23-18(19)10-24-25)13-2-3-16(20)17(21)6-13/h2-10H,11H2,1H3
InChIKeyOYNWPGCXTBFTGS-UHFFFAOYSA-N
XLogP4.13
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.35
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The IUPAC name of 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine (CID 155388780) is 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The canonical SMILES for 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine is Cc1ccncc1Cn1ncc2ncc(-c3ccc(F)c(F)c3)cc21.
What is the InChIKey of 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The InChIKey is OYNWPGCXTBFTGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N4/c1-12-4-5-22-8-15(12)11-25-19-7-14(9-23-18(19)10-24-25)13-2-3-16(20)17(21)6-13/h2-10H,11H2,1H3.
What are the key properties of 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine has a molecular weight of 336.35 g/mol, XLogP of 4.13, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-difluorophenyl)-1-[(4-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 155388780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).