5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine

C18H17F2N5 — CID 134449809

IUPAC5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine
SMILESCc1cc(-c2c3nc(C(F)F)ccc3nn2C(C)C)cc2cn[nH]c12
InChIInChI=1S/C18H17F2N5/c1-9(2)25-17(11-6-10(3)15-12(7-11)8-21-23-15)16-13(24-25)4-5-14(22-16)18(19)20/h4-9,18H,1-3H3,(H,21,23)
InChIKeySSPGQMYCCNGLBP-UHFFFAOYSA-N
MW341.37 g/mol
LogP4.80
Rot. Bonds3

About 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine

5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine (PubChem CID 134449809) has the molecular formula C18H17F2N5 and a molecular weight of 341.37 g/mol. Its IUPAC name is 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine
PubChem CID134449809
Molecular FormulaC18H17F2N5
Molecular Weight341.37 g/mol
Exact Mass341.15
IUPAC Name5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine
SMILESCc1cc(-c2c3nc(C(F)F)ccc3nn2C(C)C)cc2cn[nH]c12
InChIInChI=1S/C18H17F2N5/c1-9(2)25-17(11-6-10(3)15-12(7-11)8-21-23-15)16-13(24-25)4-5-14(22-16)18(19)20/h4-9,18H,1-3H3,(H,21,23)
InChIKeySSPGQMYCCNGLBP-UHFFFAOYSA-N
XLogP4.80
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.37
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine?
The IUPAC name of 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine (CID 134449809) is 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine.
What is the SMILES notation for 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine?
The canonical SMILES for 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine is Cc1cc(-c2c3nc(C(F)F)ccc3nn2C(C)C)cc2cn[nH]c12.
What is the InChIKey of 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine?
The InChIKey is SSPGQMYCCNGLBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2N5/c1-9(2)25-17(11-6-10(3)15-12(7-11)8-21-23-15)16-13(24-25)4-5-14(22-16)18(19)20/h4-9,18H,1-3H3,(H,21,23).
What are the key properties of 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine?
5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine has a molecular weight of 341.37 g/mol, XLogP of 4.80, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-3-(7-methyl-1H-indazol-5-yl)-2-propan-2-ylpyrazolo[4,3-b]pyridine is sourced from PubChem (CID 134449809), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).