2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine

C9H10N2 — CID 157446534

IUPAC2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine
SMILESCc1cc(C)c2c(n1)CN=C2
InChIInChI=1S/C9H10N2/c1-6-3-7(2)11-9-5-10-4-8(6)9/h3-4H,5H2,1-2H3
InChIKeyCQKFCTDYUSMWJZ-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.63
Rot. Bonds

About 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine

2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine (PubChem CID 157446534) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine.

Molecular Properties

Compound Name2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine
PubChem CID157446534
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine
SMILESCc1cc(C)c2c(n1)CN=C2
InChIInChI=1S/C9H10N2/c1-6-3-7(2)11-9-5-10-4-8(6)9/h3-4H,5H2,1-2H3
InChIKeyCQKFCTDYUSMWJZ-UHFFFAOYSA-N
XLogP1.63
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine?
The IUPAC name of 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine (CID 157446534) is 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine.
What is the SMILES notation for 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine?
The canonical SMILES for 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine is Cc1cc(C)c2c(n1)CN=C2.
What is the InChIKey of 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine?
The InChIKey is CQKFCTDYUSMWJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c1-6-3-7(2)11-9-5-10-4-8(6)9/h3-4H,5H2,1-2H3.
What are the key properties of 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine?
2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine has a molecular weight of 146.19 g/mol, XLogP of 1.63, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-7H-pyrrolo[3,4-b]pyridine is sourced from PubChem (CID 157446534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).