6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one

C13H11N3O — CID 10398747

IUPAC6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
SMILESCc1nc2c(cc1-c1ccncc1)CC(=O)N2
InChIInChI=1S/C13H11N3O/c1-8-11(9-2-4-14-5-3-9)6-10-7-12(17)16-13(10)15-8/h2-6H,7H2,1H3,(H,15,16,17)
InChIKeyQGCPLSLDJFYYEE-UHFFFAOYSA-N
MW225.25 g/mol
LogP1.95
Rot. Bonds1

About 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one

6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one (PubChem CID 10398747) has the molecular formula C13H11N3O and a molecular weight of 225.25 g/mol. Its IUPAC name is 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one.

Molecular Properties

Compound Name6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
PubChem CID10398747
Molecular FormulaC13H11N3O
Molecular Weight225.25 g/mol
Exact Mass225.09
IUPAC Name6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one
SMILESCc1nc2c(cc1-c1ccncc1)CC(=O)N2
InChIInChI=1S/C13H11N3O/c1-8-11(9-2-4-14-5-3-9)6-10-7-12(17)16-13(10)15-8/h2-6H,7H2,1H3,(H,15,16,17)
InChIKeyQGCPLSLDJFYYEE-UHFFFAOYSA-N
XLogP1.95
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one?
The IUPAC name of 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one (CID 10398747) is 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one.
What is the SMILES notation for 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one?
The canonical SMILES for 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one is Cc1nc2c(cc1-c1ccncc1)CC(=O)N2.
What is the InChIKey of 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one?
The InChIKey is QGCPLSLDJFYYEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N3O/c1-8-11(9-2-4-14-5-3-9)6-10-7-12(17)16-13(10)15-8/h2-6H,7H2,1H3,(H,15,16,17).
What are the key properties of 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one?
6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one has a molecular weight of 225.25 g/mol, XLogP of 1.95, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-pyridin-4-yl-1,3-dihydropyrrolo[2,3-b]pyridin-2-one is sourced from PubChem (CID 10398747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).