5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone

C16H13N3O — CID 121184526

IUPAC5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone
SMILESO=C(c1ccc2cc[nH]c2c1)N1Cc2cccnc2C1
InChIInChI=1S/C16H13N3O/c20-16(12-4-3-11-5-7-18-14(11)8-12)19-9-13-2-1-6-17-15(13)10-19/h1-8,18H,9-10H2
InChIKeyFRGGZIMOAZARSM-UHFFFAOYSA-N
MW263.30 g/mol
LogP2.72
Rot. Bonds1

About 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone

5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone (PubChem CID 121184526) has the molecular formula C16H13N3O and a molecular weight of 263.30 g/mol. Its IUPAC name is 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone.

Molecular Properties

Compound Name5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone
PubChem CID121184526
Molecular FormulaC16H13N3O
Molecular Weight263.30 g/mol
Exact Mass263.11
IUPAC Name5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone
SMILESO=C(c1ccc2cc[nH]c2c1)N1Cc2cccnc2C1
InChIInChI=1S/C16H13N3O/c20-16(12-4-3-11-5-7-18-14(11)8-12)19-9-13-2-1-6-17-15(13)10-19/h1-8,18H,9-10H2
InChIKeyFRGGZIMOAZARSM-UHFFFAOYSA-N
XLogP2.72
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone?
The IUPAC name of 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone (CID 121184526) is 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone.
What is the SMILES notation for 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone?
The canonical SMILES for 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone is O=C(c1ccc2cc[nH]c2c1)N1Cc2cccnc2C1.
What is the InChIKey of 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone?
The InChIKey is FRGGZIMOAZARSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c20-16(12-4-3-11-5-7-18-14(11)8-12)19-9-13-2-1-6-17-15(13)10-19/h1-8,18H,9-10H2.
What are the key properties of 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone?
5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone has a molecular weight of 263.30 g/mol, XLogP of 2.72, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dihydropyrrolo[3,4-b]pyridin-6-yl(1H-indol-6-yl)methanone is sourced from PubChem (CID 121184526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).