9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine

C25H21N5 — CID 155609606

IUPAC9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine
SMILESCN1C=CN(c2cccc(C3(c4ccn[nH]4)c4ccccc4-c4cccnc43)c2)C1
InChIInChI=1S/C25H21N5/c1-29-14-15-30(17-29)19-7-4-6-18(16-19)25(23-11-13-27-28-23)22-10-3-2-8-20(22)21-9-5-12-26-24(21)25/h2-16H,17H2,1H3,(H,27,28)
InChIKeyUEENNDJEBSPOCO-UHFFFAOYSA-N
MW391.48 g/mol
LogP4.35
Rot. Bonds3

About 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine

9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine (PubChem CID 155609606) has the molecular formula C25H21N5 and a molecular weight of 391.48 g/mol. Its IUPAC name is 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine.

Molecular Properties

Compound Name9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine
PubChem CID155609606
Molecular FormulaC25H21N5
Molecular Weight391.48 g/mol
Exact Mass391.18
IUPAC Name9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine
SMILESCN1C=CN(c2cccc(C3(c4ccn[nH]4)c4ccccc4-c4cccnc43)c2)C1
InChIInChI=1S/C25H21N5/c1-29-14-15-30(17-29)19-7-4-6-18(16-19)25(23-11-13-27-28-23)22-10-3-2-8-20(22)21-9-5-12-26-24(21)25/h2-16H,17H2,1H3,(H,27,28)
InChIKeyUEENNDJEBSPOCO-UHFFFAOYSA-N
XLogP4.35
TPSA48.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.48
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-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 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine?
The IUPAC name of 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine (CID 155609606) is 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine.
What is the SMILES notation for 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine?
The canonical SMILES for 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine is CN1C=CN(c2cccc(C3(c4ccn[nH]4)c4ccccc4-c4cccnc43)c2)C1.
What is the InChIKey of 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine?
The InChIKey is UEENNDJEBSPOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21N5/c1-29-14-15-30(17-29)19-7-4-6-18(16-19)25(23-11-13-27-28-23)22-10-3-2-8-20(22)21-9-5-12-26-24(21)25/h2-16H,17H2,1H3,(H,27,28).
What are the key properties of 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine?
9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine has a molecular weight of 391.48 g/mol, XLogP of 4.35, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-(3-methyl-2H-imidazol-1-yl)phenyl]-9-(1H-pyrazol-5-yl)indeno[2,1-b]pyridine is sourced from PubChem (CID 155609606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).