1,7-dihydropyrrolo[3,2-c]pyridin-6-one

C7H6N2O — CID 140615598

IUPAC1,7-dihydropyrrolo[3,2-c]pyridin-6-one
SMILESO=C1Cc2[nH]ccc2C=N1
InChIInChI=1S/C7H6N2O/c10-7-3-6-5(4-9-7)1-2-8-6/h1-2,4,8H,3H2
InChIKeySWZKPHHUPAWLDN-UHFFFAOYSA-N
MW134.14 g/mol
LogP0.52
Rot. Bonds

About 1,7-dihydropyrrolo[3,2-c]pyridin-6-one

1,7-dihydropyrrolo[3,2-c]pyridin-6-one (PubChem CID 140615598) has the molecular formula C7H6N2O and a molecular weight of 134.14 g/mol. Its IUPAC name is 1,7-dihydropyrrolo[3,2-c]pyridin-6-one.

Molecular Properties

Compound Name1,7-dihydropyrrolo[3,2-c]pyridin-6-one
PubChem CID140615598
Molecular FormulaC7H6N2O
Molecular Weight134.14 g/mol
Exact Mass134.05
IUPAC Name1,7-dihydropyrrolo[3,2-c]pyridin-6-one
SMILESO=C1Cc2[nH]ccc2C=N1
InChIInChI=1S/C7H6N2O/c10-7-3-6-5(4-9-7)1-2-8-6/h1-2,4,8H,3H2
InChIKeySWZKPHHUPAWLDN-UHFFFAOYSA-N
XLogP0.52
TPSA45.22 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-ethyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridine
CID 133168563
8H-pyrido[4,3-d]pyrimidin-7-one
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12,12-dimethyl-1,4,8,10-tetrazatricyclo[7.3.0.03,7]dodeca-3(7),5,8-trien-11-one
CID 143893473
5-chloro-1,5,6,7-tetrahydroindol-4-one
CID 13437716
1,6-dihydropyrrolo[3,2-b]pyridin-5-one
CID 137253734
imidazolidin-2-one;1H-pyrimidin-6-one
CID 175328967
azepine-2,4-dione;trihydrochloride
CID 66959922
piperidine;1H-pyrimidine-2,4-dione
CID 174523107
CID 157397533
CID 157397533
4,5-dihydro-1H-pyrrolo[3,2-d]pyrimidine
CID 45080239
ethane;5-methyl-6,7-dihydro-1H-indole
CID 143140793
1,7-dihydropyrano[3,4-b]pyrrole
CID 57036519

Frequently Asked Questions

What is the IUPAC name of 1,7-dihydropyrrolo[3,2-c]pyridin-6-one?
The IUPAC name of 1,7-dihydropyrrolo[3,2-c]pyridin-6-one (CID 140615598) is 1,7-dihydropyrrolo[3,2-c]pyridin-6-one.
What is the SMILES notation for 1,7-dihydropyrrolo[3,2-c]pyridin-6-one?
The canonical SMILES for 1,7-dihydropyrrolo[3,2-c]pyridin-6-one is O=C1Cc2[nH]ccc2C=N1.
What is the InChIKey of 1,7-dihydropyrrolo[3,2-c]pyridin-6-one?
The InChIKey is SWZKPHHUPAWLDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6N2O/c10-7-3-6-5(4-9-7)1-2-8-6/h1-2,4,8H,3H2.
What are the key properties of 1,7-dihydropyrrolo[3,2-c]pyridin-6-one?
1,7-dihydropyrrolo[3,2-c]pyridin-6-one has a molecular weight of 134.14 g/mol, XLogP of 0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7-dihydropyrrolo[3,2-c]pyridin-6-one is sourced from PubChem (CID 140615598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).