3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine

C20H17N5 — CID 152855482

IUPAC3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine
SMILESCC1=NCc2ncc(-c3cncc(N4CCc5ccccc54)n3)cc21
InChIInChI=1S/C20H17N5/c1-13-16-8-15(9-23-18(16)11-22-13)17-10-21-12-20(24-17)25-7-6-14-4-2-3-5-19(14)25/h2-5,8-10,12H,6-7,11H2,1H3
InChIKeyTWHKOFHRIBVQMG-UHFFFAOYSA-N
MW327.39 g/mol
LogP3.56
Rot. Bonds2

About 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine

3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine (PubChem CID 152855482) has the molecular formula C20H17N5 and a molecular weight of 327.39 g/mol. Its IUPAC name is 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine.

Molecular Properties

Compound Name3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine
PubChem CID152855482
Molecular FormulaC20H17N5
Molecular Weight327.39 g/mol
Exact Mass327.15
IUPAC Name3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine
SMILESCC1=NCc2ncc(-c3cncc(N4CCc5ccccc54)n3)cc21
InChIInChI=1S/C20H17N5/c1-13-16-8-15(9-23-18(16)11-22-13)17-10-21-12-20(24-17)25-7-6-14-4-2-3-5-19(14)25/h2-5,8-10,12H,6-7,11H2,1H3
InChIKeyTWHKOFHRIBVQMG-UHFFFAOYSA-N
XLogP3.56
TPSA54.27 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.39
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine with MolForge

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Related Compounds

3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-cyclopenta[b]pyridine;N,N-dimethyl-3-(5-methyl-7H-cyclopenta[b]pyridin-3-yl)benzenesulfonamide;methane;1-[6-(5-methyl-7H-cyclopenta[b]pyridin-3-yl)pyrazin-2-yl]pyrrolidin-2-one;5-methyl-3-[6-[(1-methylazetidin-3-yl)methyl]pyrazin-2-yl]-7H-cyclopenta[b]pyridine;5-methyl-3-(3-pyrrolidin-1-ylpyrazin-2-yl)-7H-cyclopenta[b]pyridine
CID 158465638
1-[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]ethanol
CID 102545847
(NZ)-N-[[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methylidene]hydroxylamine
CID 124502165
1-(6-fluoropyrimidin-4-yl)-2,3-dihydroindole
CID 115416366
1-(2-methyl-6-piperidin-1-ylpyrimidin-4-yl)-2,3-dihydroindole
CID 112868870
[6-(2,3-dihydroindol-1-yl)-4-methyl-3-pyridinyl]methanamine
CID 102545843
1-(5-ethenyl-4-methyl-2-pyridinyl)-2,3-dihydroindole
CID 102545853
1-(3,5-dimethylphenyl)-2,3-dihydroindole
CID 91512599
N-[[6-(3,4-dihydro-2H-quinolin-1-yl)pyrazin-2-yl]methyl]ethanamine
CID 66456379
N-benzyl-6-(2,3-dihydroindol-1-yl)-N,2-dimethylpyrimidin-4-amine
CID 112872223
6-(2,3-dihydroindol-1-yl)-N,N-diethyl-2-methylpyrimidine-4-carboxamide
CID 109373418
N-cycloheptyl-6-(2,3-dihydroindol-1-yl)-2-methylpyrimidin-4-amine
CID 112876028

Frequently Asked Questions

What is the IUPAC name of 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine?
The IUPAC name of 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine (CID 152855482) is 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine.
What is the SMILES notation for 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine?
The canonical SMILES for 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine is CC1=NCc2ncc(-c3cncc(N4CCc5ccccc54)n3)cc21.
What is the InChIKey of 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine?
The InChIKey is TWHKOFHRIBVQMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5/c1-13-16-8-15(9-23-18(16)11-22-13)17-10-21-12-20(24-17)25-7-6-14-4-2-3-5-19(14)25/h2-5,8-10,12H,6-7,11H2,1H3.
What are the key properties of 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine?
3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine has a molecular weight of 327.39 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[6-(2,3-dihydroindol-1-yl)pyrazin-2-yl]-5-methyl-7H-pyrrolo[3,4-b]pyridine is sourced from PubChem (CID 152855482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).