1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione

C10H14N2O2 — CID 134357046

IUPAC1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione
SMILESCCN1CCCC2=C1C(=O)N(C)C2=O
InChIInChI=1S/C10H14N2O2/c1-3-12-6-4-5-7-8(12)10(14)11(2)9(7)13/h3-6H2,1-2H3
InChIKeyNWGMGEQOOXKIBZ-UHFFFAOYSA-N
MW194.23 g/mol
LogP0.35
Rot. Bonds1

About 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione

1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione (PubChem CID 134357046) has the molecular formula C10H14N2O2 and a molecular weight of 194.23 g/mol. Its IUPAC name is 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione.

Molecular Properties

Compound Name1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione
PubChem CID134357046
Molecular FormulaC10H14N2O2
Molecular Weight194.23 g/mol
Exact Mass194.11
IUPAC Name1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione
SMILESCCN1CCCC2=C1C(=O)N(C)C2=O
InChIInChI=1S/C10H14N2O2/c1-3-12-6-4-5-7-8(12)10(14)11(2)9(7)13/h3-6H2,1-2H3
InChIKeyNWGMGEQOOXKIBZ-UHFFFAOYSA-N
XLogP0.35
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 50.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

1,4-diethyl-1,4-diazepane-2,3-dione
CID 12707289
1-ethylpyrrolidin-2-one;hydrazine
CID 159147234
ethane;1-ethylpyrrolidin-2-one;methanethiol
CID 91355228
2-(6-methyl-5,7-dioxo-3,4-dihydro-2H-pyrrolo[3,4-b]pyridin-1-yl)-N-(5-phenylpyrazin-2-yl)acetamide
CID 118174103
2-(6-methyl-5,7-dioxo-3,4-dihydro-2H-pyrrolo[3,4-b]pyridin-1-yl)-N-(4-pyridin-3-ylphenyl)acetamide
CID 118174114
2-(6-methyl-5,7-dioxo-3,4-dihydro-2H-pyrrolo[3,4-b]pyridin-1-yl)-N-(6-phenyl-3-pyridinyl)acetamide
CID 122652940
1-ethylpyrrolidin-2-one;sulfuric acid
CID 174895849
N-[6-[(3E)-hexa-1,3,5-trien-3-yl]-3-pyridinyl]-2-(6-methyl-5,7-dioxo-3,4-dihydro-2H-pyrrolo[3,4-b]pyridin-1-yl)acetamide
CID 144869224
2-(6-methyl-5,7-dioxo-3,4-dihydro-2H-pyrrolo[3,4-b]pyridin-1-yl)-N-(6-methyl-5-pyridin-3-ylpyrazin-2-yl)acetamide
CID 118183089
1-ethylpyrrolidin-2-one;propane-1,2-diol
CID 69270275
2-(6-methyl-5,7-dioxo-3,4-dihydro-2H-pyrrolo[3,4-b]pyridin-1-yl)-N-[5-(N-prop-2-enylidenecarbamimidoyl)-2-bicyclo[4.1.0]hepta-2,4-dienyl]acetamide
CID 144869233
1-(2-aminoethyl)-3-ethyl-1,3-diazinan-2-one
CID 82412046

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione?
The IUPAC name of 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione (CID 134357046) is 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione.
What is the SMILES notation for 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione?
The canonical SMILES for 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione is CCN1CCCC2=C1C(=O)N(C)C2=O.
What is the InChIKey of 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione?
The InChIKey is NWGMGEQOOXKIBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-3-12-6-4-5-7-8(12)10(14)11(2)9(7)13/h3-6H2,1-2H3.
What are the key properties of 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione?
1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione has a molecular weight of 194.23 g/mol, XLogP of 0.35, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-methyl-3,4-dihydro-2H-pyrrolo[3,4-b]pyridine-5,7-dione is sourced from PubChem (CID 134357046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).