2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine

C20H21N5 — CID 134449781

IUPAC2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine
SMILESCc1ccc2nn(C3CCCC3)c(-c3cc(C)c4[nH]ncc4c3)c2n1
InChIInChI=1S/C20H21N5/c1-12-9-14(10-15-11-21-23-18(12)15)20-19-17(8-7-13(2)22-19)24-25(20)16-5-3-4-6-16/h7-11,16H,3-6H2,1-2H3,(H,21,23)
InChIKeyXTQCDFCZZNNWNI-UHFFFAOYSA-N
MW331.42 g/mol
LogP4.71
Rot. Bonds2

About 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine

2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine (PubChem CID 134449781) has the molecular formula C20H21N5 and a molecular weight of 331.42 g/mol. Its IUPAC name is 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine.

Molecular Properties

Compound Name2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine
PubChem CID134449781
Molecular FormulaC20H21N5
Molecular Weight331.42 g/mol
Exact Mass331.18
IUPAC Name2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine
SMILESCc1ccc2nn(C3CCCC3)c(-c3cc(C)c4[nH]ncc4c3)c2n1
InChIInChI=1S/C20H21N5/c1-12-9-14(10-15-11-21-23-18(12)15)20-19-17(8-7-13(2)22-19)24-25(20)16-5-3-4-6-16/h7-11,16H,3-6H2,1-2H3,(H,21,23)
InChIKeyXTQCDFCZZNNWNI-UHFFFAOYSA-N
XLogP4.71
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine?
The IUPAC name of 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine (CID 134449781) is 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine.
What is the SMILES notation for 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine?
The canonical SMILES for 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine is Cc1ccc2nn(C3CCCC3)c(-c3cc(C)c4[nH]ncc4c3)c2n1.
What is the InChIKey of 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine?
The InChIKey is XTQCDFCZZNNWNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N5/c1-12-9-14(10-15-11-21-23-18(12)15)20-19-17(8-7-13(2)22-19)24-25(20)16-5-3-4-6-16/h7-11,16H,3-6H2,1-2H3,(H,21,23).
What are the key properties of 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine?
2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine has a molecular weight of 331.42 g/mol, XLogP of 4.71, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-5-methyl-3-(7-methyl-1H-indazol-5-yl)pyrazolo[4,3-b]pyridine is sourced from PubChem (CID 134449781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).