5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one

C10H14N2O — CID 151318248

IUPAC5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one
SMILESCc1c2c(c(=O)n(C)c1C)CNC2
InChIInChI=1S/C10H14N2O/c1-6-7(2)12(3)10(13)9-5-11-4-8(6)9/h11H,4-5H2,1-3H3
InChIKeyOFXBOZOSLFJVIK-UHFFFAOYSA-N
MW178.23 g/mol
LogP0.61
Rot. Bonds

About 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one

5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one (PubChem CID 151318248) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one.

Molecular Properties

Compound Name5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one
PubChem CID151318248
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one
SMILESCc1c2c(c(=O)n(C)c1C)CNC2
InChIInChI=1S/C10H14N2O/c1-6-7(2)12(3)10(13)9-5-11-4-8(6)9/h11H,4-5H2,1-3H3
InChIKeyOFXBOZOSLFJVIK-UHFFFAOYSA-N
XLogP0.61
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one?
The IUPAC name of 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one (CID 151318248) is 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one.
What is the SMILES notation for 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one?
The canonical SMILES for 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one is Cc1c2c(c(=O)n(C)c1C)CNC2.
What is the InChIKey of 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one?
The InChIKey is OFXBOZOSLFJVIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c1-6-7(2)12(3)10(13)9-5-11-4-8(6)9/h11H,4-5H2,1-3H3.
What are the key properties of 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one?
5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one has a molecular weight of 178.23 g/mol, XLogP of 0.61, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7-trimethyl-2,3-dihydro-1H-pyrrolo[3,4-c]pyridin-4-one is sourced from PubChem (CID 151318248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).