3-methyl-7H-pyrrolo[3,4-b]pyridine

C8H8N2 — CID 158638402

IUPAC3-methyl-7H-pyrrolo[3,4-b]pyridine
SMILESCc1cnc2c(c1)C=NC2
InChIInChI=1S/C8H8N2/c1-6-2-7-4-9-5-8(7)10-3-6/h2-4H,5H2,1H3
InChIKeyURHLETVDNQGHKE-UHFFFAOYSA-N
MW132.17 g/mol
LogP1.32
Rot. Bonds

About 3-methyl-7H-pyrrolo[3,4-b]pyridine

3-methyl-7H-pyrrolo[3,4-b]pyridine (PubChem CID 158638402) has the molecular formula C8H8N2 and a molecular weight of 132.17 g/mol. Its IUPAC name is 3-methyl-7H-pyrrolo[3,4-b]pyridine.

Molecular Properties

Compound Name3-methyl-7H-pyrrolo[3,4-b]pyridine
PubChem CID158638402
Molecular FormulaC8H8N2
Molecular Weight132.17 g/mol
Exact Mass132.07
IUPAC Name3-methyl-7H-pyrrolo[3,4-b]pyridine
SMILESCc1cnc2c(c1)C=NC2
InChIInChI=1S/C8H8N2/c1-6-2-7-4-9-5-8(7)10-3-6/h2-4H,5H2,1H3
InChIKeyURHLETVDNQGHKE-UHFFFAOYSA-N
XLogP1.32
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.17
LogP ≤ 51.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(4-fluoro-3-methylphenyl)-5-methylpyrimidin-4-yl]-7H-pyrrolo[3,4-b]pyridin-3-amine
CID 152818572
3,7-dimethyl-1,4-dihydropyrido[3,2-d]pyrimidin-2-one;ethane
CID 170981748
ethane;3-methyl-5,6,7,8-tetrahydroquinoline
CID 143839109
ethane;6-methyl-1,3-dihydropyrrolo[3,2-b]pyridin-2-one
CID 171527396
3,7-dimethyl-6,8-dihydro-5H-1,7-naphthyridine
CID 59437026
3-methyl-7H-cyclohepta[b]pyridine
CID 130255856
3-methylspiro[7H-cyclopenta[b]pyridine-6,4'-piperidine]-5-one
CID 155891050
7H-pyrrolo[3,4-d]pyrimidine-2-carbaldehyde
CID 175194111
2,6-dimethyl-2,3-dihydrothieno[3,2-b]pyridine
CID 58047092
CID 156818597
CID 156818597
ethane;4-methyl-7H-pyrrolo[3,4-d]pyrimidine
CID 162358341
2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine
CID 157446534

Frequently Asked Questions

What is the IUPAC name of 3-methyl-7H-pyrrolo[3,4-b]pyridine?
The IUPAC name of 3-methyl-7H-pyrrolo[3,4-b]pyridine (CID 158638402) is 3-methyl-7H-pyrrolo[3,4-b]pyridine.
What is the SMILES notation for 3-methyl-7H-pyrrolo[3,4-b]pyridine?
The canonical SMILES for 3-methyl-7H-pyrrolo[3,4-b]pyridine is Cc1cnc2c(c1)C=NC2.
What is the InChIKey of 3-methyl-7H-pyrrolo[3,4-b]pyridine?
The InChIKey is URHLETVDNQGHKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2/c1-6-2-7-4-9-5-8(7)10-3-6/h2-4H,5H2,1H3.
What are the key properties of 3-methyl-7H-pyrrolo[3,4-b]pyridine?
3-methyl-7H-pyrrolo[3,4-b]pyridine has a molecular weight of 132.17 g/mol, XLogP of 1.32, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-7H-pyrrolo[3,4-b]pyridine is sourced from PubChem (CID 158638402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).