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

C7H4Br2N2O — CID 11185425

IUPAC2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one
SMILESO=c1[nH]ccc2c(Br)c(Br)[nH]c12
InChIInChI=1S/C7H4Br2N2O/c8-4-3-1-2-10-7(12)5(3)11-6(4)9/h1-2,11H,(H,10,12)
InChIKeyLPUJLPXDOIWZML-UHFFFAOYSA-N
MW291.93 g/mol
LogP2.38
Rot. Bonds

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

2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one (PubChem CID 11185425) has the molecular formula C7H4Br2N2O and a molecular weight of 291.93 g/mol. Its IUPAC name is 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one.

Molecular Properties

Compound Name2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one
PubChem CID11185425
Molecular FormulaC7H4Br2N2O
Molecular Weight291.93 g/mol
Exact Mass289.87
IUPAC Name2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one
SMILESO=c1[nH]ccc2c(Br)c(Br)[nH]c12
InChIInChI=1S/C7H4Br2N2O/c8-4-3-1-2-10-7(12)5(3)11-6(4)9/h1-2,11H,(H,10,12)
InChIKeyLPUJLPXDOIWZML-UHFFFAOYSA-N
XLogP2.38
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.93
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4,5-Dibromo-1h-pyrrole-2-carboxamide
CID 14056555
6-bromo-8-methyl-2H-pyrrolo[1,2-a]pyrazin-1-one
CID 139341517
3-bromo-1-methyl-1H,6H,7H-pyrrolo(2,3-c)pyridin-7-one
CID 73994664
6-Bromopyrrolo[1,2-a]pyrazin-1-ol
CID 84026873
N-benzyl-4,5-dibromo-1H-pyrrole-2-carboxamide
CID 76317700
4-bromo-6-methyl-1H,6H,7H-pyrrolo[2,3-c]pyridin-7-one
CID 57329766
4,5-dibromo-N-(4-phenylbutyl)-1H-pyrrole-2-carboxamide
CID 76310474
4,5-dibromo-N-(2-phenylethyl)-1H-pyrrole-2-carboxamide
CID 76321404
4,5-dibromo-N-(3-phenylpropyl)-1H-pyrrole-2-carboxamide
CID 76321405
Ugibohlin
CID 11079644
Dibromopyrrole-2-carboxamide
CID 44718317
6,7-dibromo-1H,2H-pyrrolo[1,2-a]pyrazin-1-one
CID 11483192

Frequently Asked Questions

What is the IUPAC name of 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one?
The IUPAC name of 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one (CID 11185425) is 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one.
What is the SMILES notation for 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one?
The canonical SMILES for 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one is O=c1[nH]ccc2c(Br)c(Br)[nH]c12.
What is the InChIKey of 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one?
The InChIKey is LPUJLPXDOIWZML-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4Br2N2O/c8-4-3-1-2-10-7(12)5(3)11-6(4)9/h1-2,11H,(H,10,12).
What are the key properties of 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one?
2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one has a molecular weight of 291.93 g/mol, XLogP of 2.38, 0 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dibromo-1,6-dihydropyrrolo[2,3-c]pyridin-7-one is sourced from PubChem (CID 11185425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).