3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine

C23H21N5 — CID 90644307

IUPAC3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine
SMILESCc1ccc2c(c1)nc(CCn1nc(C)c3cccnc31)n2-c1ccccc1
InChIInChI=1S/C23H21N5/c1-16-10-11-21-20(15-16)25-22(28(21)18-7-4-3-5-8-18)12-14-27-23-19(17(2)26-27)9-6-13-24-23/h3-11,13,15H,12,14H2,1-2H3
InChIKeyFBITZLCEEWLMQW-UHFFFAOYSA-N
MW367.46 g/mol
LogP4.63
Rot. Bonds4

About 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine

3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine (PubChem CID 90644307) has the molecular formula C23H21N5 and a molecular weight of 367.46 g/mol. Its IUPAC name is 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine.

Molecular Properties

Compound Name3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine
PubChem CID90644307
Molecular FormulaC23H21N5
Molecular Weight367.46 g/mol
Exact Mass367.18
IUPAC Name3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine
SMILESCc1ccc2c(c1)nc(CCn1nc(C)c3cccnc31)n2-c1ccccc1
InChIInChI=1S/C23H21N5/c1-16-10-11-21-20(15-16)25-22(28(21)18-7-4-3-5-8-18)12-14-27-23-19(17(2)26-27)9-6-13-24-23/h3-11,13,15H,12,14H2,1-2H3
InChIKeyFBITZLCEEWLMQW-UHFFFAOYSA-N
XLogP4.63
TPSA48.53 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.46
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine?
The IUPAC name of 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine (CID 90644307) is 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine.
What is the SMILES notation for 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine?
The canonical SMILES for 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine is Cc1ccc2c(c1)nc(CCn1nc(C)c3cccnc31)n2-c1ccccc1.
What is the InChIKey of 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine?
The InChIKey is FBITZLCEEWLMQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N5/c1-16-10-11-21-20(15-16)25-22(28(21)18-7-4-3-5-8-18)12-14-27-23-19(17(2)26-27)9-6-13-24-23/h3-11,13,15H,12,14H2,1-2H3.
What are the key properties of 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine?
3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine has a molecular weight of 367.46 g/mol, XLogP of 4.63, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[2-(5-methyl-1-phenylbenzimidazol-2-yl)ethyl]pyrazolo[5,4-b]pyridine is sourced from PubChem (CID 90644307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).