N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine

C19H14F2N4O — CID 11696024

IUPACN-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine
SMILESCOc1ccccc1-c1[nH]nc2nc(Nc3ccc(F)cc3F)ccc12
InChIInChI=1S/C19H14F2N4O/c1-26-16-5-3-2-4-12(16)18-13-7-9-17(23-19(13)25-24-18)22-15-8-6-11(20)10-14(15)21/h2-10H,1H3,(H2,22,23,24,25)
InChIKeyRDEMWEUSVICBQT-UHFFFAOYSA-N
MW352.34 g/mol
LogP4.66
Rot. Bonds4

About N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine

N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine (PubChem CID 11696024) has the molecular formula C19H14F2N4O and a molecular weight of 352.34 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine
PubChem CID11696024
Molecular FormulaC19H14F2N4O
Molecular Weight352.34 g/mol
Exact Mass352.11
IUPAC NameN-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine
SMILESCOc1ccccc1-c1[nH]nc2nc(Nc3ccc(F)cc3F)ccc12
InChIInChI=1S/C19H14F2N4O/c1-26-16-5-3-2-4-12(16)18-13-7-9-17(23-19(13)25-24-18)22-15-8-6-11(20)10-14(15)21/h2-10H,1H3,(H2,22,23,24,25)
InChIKeyRDEMWEUSVICBQT-UHFFFAOYSA-N
XLogP4.66
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.34
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3,5-Dimethoxyphenyl)-3-(4-fluorophenyl)-1H-pyrazolo[3,4-b]pyridine
CID 24786010
3-(4-phenoxyphenyl)-1H-pyrazolo(3,4-d)pyrimidin-4-amine
CID 22346757
N-(3-chlorophenyl)-3-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 5327841
Sdccggsk-0000007.P001
CID 9604943
N-(2,4-difluorophenyl)-3-(5-(3-(dimethylamino)prop-1-ynyl)-2-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CID 11590141
N-(2,4-difluorophenyl)-3-(2-methoxy-5-(3-(4-methylpiperazin-1-yl)prop-1-ynyl)phenyl)-1H-pyrazolo[3,4-d]pyrimidin-6-amine
CID 11634558
N-[(4-fluorophenyl)methylideneamino]-1-(3-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-4-amine
CID 53239950
2-methoxy-N-[2-(4-methoxyphenyl)ethyl]-6-[4-methoxy-3-(2H-tetrazol-5-yl)phenyl]pyrimidin-4-amine
CID 53325847
2-(4-Methoxyphenyl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine
CID 754731
N-[6-(3-methoxyphenyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]cyclopropanecarboxamide
CID 6539570
6-(4-Fluorophenyl)-5-(4-Methoxyphenyl)-7h-Pyrrolo[2,3-D]pyrimidine-2,4-Diamine
CID 86580361
(1E)-1-[(3,4-difluorophenyl)methylidene]-2-[1-(3-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]hydrazine
CID 91895692

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine?
The IUPAC name of N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine (CID 11696024) is N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine.
What is the SMILES notation for N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine?
The canonical SMILES for N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine is COc1ccccc1-c1[nH]nc2nc(Nc3ccc(F)cc3F)ccc12.
What is the InChIKey of N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine?
The InChIKey is RDEMWEUSVICBQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F2N4O/c1-26-16-5-3-2-4-12(16)18-13-7-9-17(23-19(13)25-24-18)22-15-8-6-11(20)10-14(15)21/h2-10H,1H3,(H2,22,23,24,25).
What are the key properties of N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine?
N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine has a molecular weight of 352.34 g/mol, XLogP of 4.66, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-3-(2-methoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-6-amine is sourced from PubChem (CID 11696024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).