5-methyl-4-methylidenepyrrolo[3,4-b]pyridine

C9H8N2 — CID 140956164

IUPAC5-methyl-4-methylidenepyrrolo[3,4-b]pyridine
SMILESC=c1ccnc2c1=C(C)N=C2
InChIInChI=1S/C9H8N2/c1-6-3-4-10-8-5-11-7(2)9(6)8/h3-5H,1H2,2H3
InChIKeyTUYDHTDZIULGDS-UHFFFAOYSA-N
MW144.18 g/mol
LogP0.05
Rot. Bonds

About 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine

5-methyl-4-methylidenepyrrolo[3,4-b]pyridine (PubChem CID 140956164) has the molecular formula C9H8N2 and a molecular weight of 144.18 g/mol. Its IUPAC name is 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine.

Molecular Properties

Compound Name5-methyl-4-methylidenepyrrolo[3,4-b]pyridine
PubChem CID140956164
Molecular FormulaC9H8N2
Molecular Weight144.18 g/mol
Exact Mass144.07
IUPAC Name5-methyl-4-methylidenepyrrolo[3,4-b]pyridine
SMILESC=c1ccnc2c1=C(C)N=C2
InChIInChI=1S/C9H8N2/c1-6-3-4-10-8-5-11-7(2)9(6)8/h3-5H,1H2,2H3
InChIKeyTUYDHTDZIULGDS-UHFFFAOYSA-N
XLogP0.05
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.18
LogP ≤ 50.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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Pyrrolo[2,3-c]carbazole
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Pyrrolo[2,3-f]indole
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Pyrrolo-[3,2-f]indole
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1h Pyrido[4,3 b]indole hydrochloride
CID 21499446
1h Pyrido[4,3 b]indole
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CID 21886979

Frequently Asked Questions

What is the IUPAC name of 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine?
The IUPAC name of 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine (CID 140956164) is 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine.
What is the SMILES notation for 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine?
The canonical SMILES for 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine is C=c1ccnc2c1=C(C)N=C2.
What is the InChIKey of 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine?
The InChIKey is TUYDHTDZIULGDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2/c1-6-3-4-10-8-5-11-7(2)9(6)8/h3-5H,1H2,2H3.
What are the key properties of 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine?
5-methyl-4-methylidenepyrrolo[3,4-b]pyridine has a molecular weight of 144.18 g/mol, XLogP of 0.05, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-4-methylidenepyrrolo[3,4-b]pyridine is sourced from PubChem (CID 140956164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).