2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine

C12H12N4 — CID 153303828

IUPAC2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine
SMILESCc1c(-c2cc3ncccc3[nH]2)cnn1C
InChIInChI=1S/C12H12N4/c1-8-9(7-14-16(8)2)11-6-12-10(15-11)4-3-5-13-12/h3-7,15H,1-2H3
InChIKeyFUBTZVKXXHVQKA-UHFFFAOYSA-N
MW212.26 g/mol
LogP2.27
Rot. Bonds1

About 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine

2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine (PubChem CID 153303828) has the molecular formula C12H12N4 and a molecular weight of 212.26 g/mol. Its IUPAC name is 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine.

Molecular Properties

Compound Name2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine
PubChem CID153303828
Molecular FormulaC12H12N4
Molecular Weight212.26 g/mol
Exact Mass212.11
IUPAC Name2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine
SMILESCc1c(-c2cc3ncccc3[nH]2)cnn1C
InChIInChI=1S/C12H12N4/c1-8-9(7-14-16(8)2)11-6-12-10(15-11)4-3-5-13-12/h3-7,15H,1-2H3
InChIKeyFUBTZVKXXHVQKA-UHFFFAOYSA-N
XLogP2.27
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.26
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methylphenyl)-1H-pyrrolo[3,2-b]pyridine
CID 84676205
2-(1H-indol-2-yl)-1H-pyrrolo[3,2-b]pyridine
CID 156702024
6-chloro-1-methyl-3-(1H-pyrrolo[3,2-b]pyridin-2-yl)indazole
CID 137153210
4-[3-(1,5-dimethylpyrazol-4-yl)-1H-pyrazol-5-yl]-1,5-dimethylpyrazole
CID 19588300
2-(1-benzofuran-2-yl)-1H-pyrrolo[3,2-b]pyridine
CID 130319772
3-methyl-1H-1,5-naphthyridin-2-one;molecular hydrogen
CID 176580356
6-(1,5-dimethylpyrazol-4-yl)-3-pyridin-3-yl-9H-pyrido[3,4-b]indole
CID 123980413
2-(1H-pyrrolo[2,3-b]pyridin-5-yl)-1H-pyrrolo[3,2-b]pyridine
CID 134350502
2-(1,5-dimethylpyrazol-4-yl)-6-fluoro-1H-benzimidazole
CID 60977715
2-(1H-pyrrolo[3,2-b]pyridin-2-yl)-[1,3]oxazolo[4,5-b]pyridine
CID 141361591
4-propan-2-yl-2-(1H-pyrrolo[3,2-b]pyridin-2-yl)-4,5-dihydro-1,3-thiazole
CID 77108427
4-[(1R)-1-[7-(1,5-dimethylpyrazol-4-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 149099758

Frequently Asked Questions

What is the IUPAC name of 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine?
The IUPAC name of 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine (CID 153303828) is 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine.
What is the SMILES notation for 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine?
The canonical SMILES for 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine is Cc1c(-c2cc3ncccc3[nH]2)cnn1C.
What is the InChIKey of 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine?
The InChIKey is FUBTZVKXXHVQKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4/c1-8-9(7-14-16(8)2)11-6-12-10(15-11)4-3-5-13-12/h3-7,15H,1-2H3.
What are the key properties of 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine?
2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine has a molecular weight of 212.26 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,5-dimethylpyrazol-4-yl)-1H-pyrrolo[3,2-b]pyridine is sourced from PubChem (CID 153303828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).