5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine

C13H11N3 — CID 170012021

IUPAC5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine
SMILESCc1cnc2[nH]cc(-c3cccnc3)c2c1
InChIInChI=1S/C13H11N3/c1-9-5-11-12(8-16-13(11)15-6-9)10-3-2-4-14-7-10/h2-8H,1H3,(H,15,16)
InChIKeyTWHCYAGNKZFYHE-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.93
Rot. Bonds1

About 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine

5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine (PubChem CID 170012021) has the molecular formula C13H11N3 and a molecular weight of 209.25 g/mol. Its IUPAC name is 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine
PubChem CID170012021
Molecular FormulaC13H11N3
Molecular Weight209.25 g/mol
Exact Mass209.10
IUPAC Name5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine
SMILESCc1cnc2[nH]cc(-c3cccnc3)c2c1
InChIInChI=1S/C13H11N3/c1-9-5-11-12(8-16-13(11)15-6-9)10-3-2-4-14-7-10/h2-8H,1H3,(H,15,16)
InChIKeyTWHCYAGNKZFYHE-UHFFFAOYSA-N
XLogP2.93
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(5-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)phenol
CID 11953295
methyl-[1-(3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)azetidin-3-yl]cyanamide
CID 122421484
4-(5-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine
CID 129206992
4-(5-methyl-1H-pyrrolo[2,3-b]pyridin-3-yl)pyrimidin-2-amine
CID 91462753
5-methyl-3-(1-tritylpyrazol-4-yl)-1H-pyrrolo[2,3-b]pyridine
CID 67588144
5-fluoro-3-pyridin-3-yl-1H-pyrrolo[2,3-c]pyridine
CID 165444709
3-(3-pyridin-4-yl-1H-pyrrolo[2,3-b]pyridin-5-yl)phenol
CID 59699898
5-(3-fluorophenyl)-3-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 118562635
N-[5-(3-methylphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]pyridine-3-carboxamide
CID 155540633
3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine
CID 59812098
3-(2,5-dimethyl-4-pyridin-3-ylphenyl)pyridine
CID 155748097
3-pyridazin-4-yl-1H-pyrrolo[2,3-b]pyridine
CID 175782285

Frequently Asked Questions

What is the IUPAC name of 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine?
The IUPAC name of 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine (CID 170012021) is 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine.
What is the SMILES notation for 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine?
The canonical SMILES for 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine is Cc1cnc2[nH]cc(-c3cccnc3)c2c1.
What is the InChIKey of 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine?
The InChIKey is TWHCYAGNKZFYHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3/c1-9-5-11-12(8-16-13(11)15-6-9)10-3-2-4-14-7-10/h2-8H,1H3,(H,15,16).
What are the key properties of 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine?
5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine has a molecular weight of 209.25 g/mol, XLogP of 2.93, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-3-pyridin-3-yl-1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 170012021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).