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

C19H14F2N4 — CID 155399930

IUPAC6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
SMILESCc1cncc(Cn2ncc3ncc(-c4ccc(F)c(F)c4)cc32)c1
InChIInChI=1S/C19H14F2N4/c1-12-4-13(8-22-7-12)11-25-19-6-15(9-23-18(19)10-24-25)14-2-3-16(20)17(21)5-14/h2-10H,11H2,1H3
InChIKeyMPQMYNCWKNSDNY-UHFFFAOYSA-N
MW336.35 g/mol
LogP4.13
Rot. Bonds3

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

6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine (PubChem CID 155399930) has the molecular formula C19H14F2N4 and a molecular weight of 336.35 g/mol. Its IUPAC name is 6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
PubChem CID155399930
Molecular FormulaC19H14F2N4
Molecular Weight336.35 g/mol
Exact Mass336.12
IUPAC Name6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine
SMILESCc1cncc(Cn2ncc3ncc(-c4ccc(F)c(F)c4)cc32)c1
InChIInChI=1S/C19H14F2N4/c1-12-4-13(8-22-7-12)11-25-19-6-15(9-23-18(19)10-24-25)14-2-3-16(20)17(21)5-14/h2-10H,11H2,1H3
InChIKeyMPQMYNCWKNSDNY-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-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The IUPAC name of 6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine (CID 155399930) is 6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine.
What is the SMILES notation for 6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The canonical SMILES for 6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine is Cc1cncc(Cn2ncc3ncc(-c4ccc(F)c(F)c4)cc32)c1.
What is the InChIKey of 6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
The InChIKey is MPQMYNCWKNSDNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N4/c1-12-4-13(8-22-7-12)11-25-19-6-15(9-23-18(19)10-24-25)14-2-3-16(20)17(21)5-14/h2-10H,11H2,1H3.
What are the key properties of 6-(3,4-difluorophenyl)-1-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine?
6-(3,4-difluorophenyl)-1-[(5-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-[(5-methyl-3-pyridinyl)methyl]pyrazolo[4,5-b]pyridine is sourced from PubChem (CID 155399930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).