3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one

C8H8N2O2 — CID 11252187

IUPAC3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one
SMILESCN1C(=O)c2ccncc2C1O
InChIInChI=1S/C8H8N2O2/c1-10-7(11)5-2-3-9-4-6(5)8(10)12/h2-4,8,12H,1H3
InChIKeyMVKALWANBHXUNK-UHFFFAOYSA-N
MW164.16 g/mol
LogP0.16
Rot. Bonds

About 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one

3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one (PubChem CID 11252187) has the molecular formula C8H8N2O2 and a molecular weight of 164.16 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one.

Molecular Properties

Compound Name3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one
PubChem CID11252187
Molecular FormulaC8H8N2O2
Molecular Weight164.16 g/mol
Exact Mass164.06
IUPAC Name3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one
SMILESCN1C(=O)c2ccncc2C1O
InChIInChI=1S/C8H8N2O2/c1-10-7(11)5-2-3-9-4-6(5)8(10)12/h2-4,8,12H,1H3
InChIKeyMVKALWANBHXUNK-UHFFFAOYSA-N
XLogP0.16
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.16
LogP ≤ 50.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one?
The IUPAC name of 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one (CID 11252187) is 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one.
What is the SMILES notation for 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one?
The canonical SMILES for 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one is CN1C(=O)c2ccncc2C1O.
What is the InChIKey of 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one?
The InChIKey is MVKALWANBHXUNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2O2/c1-10-7(11)5-2-3-9-4-6(5)8(10)12/h2-4,8,12H,1H3.
What are the key properties of 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one?
3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one has a molecular weight of 164.16 g/mol, XLogP of 0.16, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-3H-pyrrolo[3,4-c]pyridin-1-one is sourced from PubChem (CID 11252187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).