4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine

C16H10ClFN6 — CID 90021024

IUPAC4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine
SMILESCc1cncc(-c2cc3[nH]ncc3c(-c3ccc(Cl)c(F)n3)n2)n1
InChIInChI=1S/C16H10ClFN6/c1-8-5-19-7-14(21-8)13-4-12-9(6-20-24-12)15(22-13)11-3-2-10(17)16(18)23-11/h2-7H,1H3,(H,20,24)
InChIKeyOXOSMUIGGIQZKD-UHFFFAOYSA-N
MW340.75 g/mol
LogP3.58
Rot. Bonds2

About 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine

4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine (PubChem CID 90021024) has the molecular formula C16H10ClFN6 and a molecular weight of 340.75 g/mol. Its IUPAC name is 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine.

Molecular Properties

Compound Name4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine
PubChem CID90021024
Molecular FormulaC16H10ClFN6
Molecular Weight340.75 g/mol
Exact Mass340.06
IUPAC Name4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine
SMILESCc1cncc(-c2cc3[nH]ncc3c(-c3ccc(Cl)c(F)n3)n2)n1
InChIInChI=1S/C16H10ClFN6/c1-8-5-19-7-14(21-8)13-4-12-9(6-20-24-12)15(22-13)11-3-2-10(17)16(18)23-11/h2-7H,1H3,(H,20,24)
InChIKeyOXOSMUIGGIQZKD-UHFFFAOYSA-N
XLogP3.58
TPSA80.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.75
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

RepSox
CID 449054
2-(4-fluorophenyl)-4-(3-(pyridin-2-yl)-1H-pyrazol-4-yl)pyridine
CID 9858084
N-[2-(5-Chloro-2-Fluorophenyl)pyridin-4-Yl]-2-[(Piperidin-4-Yl)methyl]-2h-Pyrazolo[4,3-B]pyridin-7-Amine
CID 54671256
3-Methyl-5-(Pyridin-3-Yl)-2h-Pyrazolo[3,4-C]pyridine
CID 71254055
N-(2-(2,5-difluorophenyl)-5-methylpyridin-4-yl)-1H-pyrazolo[4,3-b]pyridin-7-amine
CID 54671061
5-(1-methylpyrazol-4-yl)-3-(6-piperidin-4-yl-2-pyridinyl)-1H-pyrazolo[3,4-c]pyridine
CID 71253727
(3R)-1-[3-[5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl]phenyl]piperidin-3-amine
CID 71254066
N-(5,6-dichloro-3-pyridinyl)-1-(1H-indazol-5-yl)methanimine
CID 77844771
7-Chloro-2-(4-fluorophenyl)-3-(4-pyridinyl)pyrazolo[1,5-a]pyridine
CID 9858407
2-(3-Pyridin-2-yl-1H-pyrazol-4-yl)-1,5-naphthyridine
CID 9925495
2-[4-chlorophenyl]-4-(3-pyridin-2-yl-1H-pyrazol-4-yl)pyridine
CID 9945516
2-[2-fluorophenyl]-4-(3-pyridin-2-yl-1H-pyrazol-4-yl)pyridine
CID 11638261

Frequently Asked Questions

What is the IUPAC name of 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine?
The IUPAC name of 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine (CID 90021024) is 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine.
What is the SMILES notation for 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine?
The canonical SMILES for 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine is Cc1cncc(-c2cc3[nH]ncc3c(-c3ccc(Cl)c(F)n3)n2)n1.
What is the InChIKey of 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine?
The InChIKey is OXOSMUIGGIQZKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClFN6/c1-8-5-19-7-14(21-8)13-4-12-9(6-20-24-12)15(22-13)11-3-2-10(17)16(18)23-11/h2-7H,1H3,(H,20,24).
What are the key properties of 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine?
4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine has a molecular weight of 340.75 g/mol, XLogP of 3.58, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-chloro-6-fluoro-2-pyridinyl)-6-(6-methylpyrazin-2-yl)-1H-pyrazolo[4,3-c]pyridine is sourced from PubChem (CID 90021024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).