2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine

C22H18N8S — CID 145248708

IUPAC2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine
SMILESCCc1nn(C)cc1-c1ccc2[nH]nc(-c3nc4c(-c5cccs5)cncc4[nH]3)c2n1
InChIInChI=1S/C22H18N8S/c1-3-14-13(11-30(2)29-14)15-6-7-16-20(24-15)21(28-27-16)22-25-17-10-23-9-12(19(17)26-22)18-5-4-8-31-18/h4-11H,3H2,1-2H3,(H,25,26)(H,27,28)
InChIKeyWBMINIWHIIVRDJ-UHFFFAOYSA-N
MW426.51 g/mol
LogP4.59
Rot. Bonds4

About 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine

2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine (PubChem CID 145248708) has the molecular formula C22H18N8S and a molecular weight of 426.51 g/mol. Its IUPAC name is 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine.

Molecular Properties

Compound Name2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine
PubChem CID145248708
Molecular FormulaC22H18N8S
Molecular Weight426.51 g/mol
Exact Mass426.14
IUPAC Name2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine
SMILESCCc1nn(C)cc1-c1ccc2[nH]nc(-c3nc4c(-c5cccs5)cncc4[nH]3)c2n1
InChIInChI=1S/C22H18N8S/c1-3-14-13(11-30(2)29-14)15-6-7-16-20(24-15)21(28-27-16)22-25-17-10-23-9-12(19(17)26-22)18-5-4-8-31-18/h4-11H,3H2,1-2H3,(H,25,26)(H,27,28)
InChIKeyWBMINIWHIIVRDJ-UHFFFAOYSA-N
XLogP4.59
TPSA100.96 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.51
LogP ≤ 54.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine with MolForge

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Related Compounds

5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]pyridin-3-ol
CID 137311743
2-[5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine
CID 137110248
[1-methyl-4-[3-[7-(4-methylimidazol-1-yl)-3H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]pyrazol-3-yl]methanol
CID 137110413
N-[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]benzamide
CID 137110202
1-cyclopentyl-N-[[5-[3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]methyl]methanamine
CID 137109963
[4-[3-[4-(5-chlorothiophen-2-yl)-1H-benzimidazol-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]-1-methylpyrazol-3-yl]methanol
CID 137109517
[1-methyl-4-[3-[4-(5-methylthiophen-2-yl)-1H-imidazo[4,5-c]pyridin-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]pyrazol-3-yl]methanol
CID 137312429
[4-[3-[4-(1,3-benzodioxol-5-yl)-1H-benzimidazol-2-yl]-1H-pyrazolo[4,3-b]pyridin-5-yl]-1-methylpyrazol-3-yl]methanol
CID 137109575
N-[[5-[3-(4-thiophen-2-yl-1H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[4,3-b]pyridin-5-yl]-3-pyridinyl]methyl]ethanamine
CID 137038678
2-[5-(5-methoxy-3-pyridinyl)-1H-pyrazolo[3,4-c]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine
CID 136947325
5-[4-fluoro-3-(7-thiophen-2-yl-3H-imidazo[4,5-c]pyridin-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]-N,N-dimethylpyridin-3-amine
CID 136946983
2-(5-pyridin-4-yl-1H-pyrazolo[4,3-b]pyridin-3-yl)-7-thiophen-3-yl-3H-imidazo[4,5-c]pyridine
CID 137311638

Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine?
The IUPAC name of 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine (CID 145248708) is 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine.
What is the SMILES notation for 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine?
The canonical SMILES for 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine is CCc1nn(C)cc1-c1ccc2[nH]nc(-c3nc4c(-c5cccs5)cncc4[nH]3)c2n1.
What is the InChIKey of 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine?
The InChIKey is WBMINIWHIIVRDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N8S/c1-3-14-13(11-30(2)29-14)15-6-7-16-20(24-15)21(28-27-16)22-25-17-10-23-9-12(19(17)26-22)18-5-4-8-31-18/h4-11H,3H2,1-2H3,(H,25,26)(H,27,28).
What are the key properties of 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine?
2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine has a molecular weight of 426.51 g/mol, XLogP of 4.59, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-ethyl-1-methylpyrazol-4-yl)-1H-pyrazolo[4,3-b]pyridin-3-yl]-7-thiophen-2-yl-3H-imidazo[4,5-c]pyridine is sourced from PubChem (CID 145248708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).