pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone

C13H9N3O — CID 59506817

IUPACpyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
SMILESO=C(c1ccccn1)c1c[nH]c2ncccc12
InChIInChI=1S/C13H9N3O/c17-12(11-5-1-2-6-14-11)10-8-16-13-9(10)4-3-7-15-13/h1-8H,(H,15,16)
InChIKeyGVEBBOSRLRCYOI-UHFFFAOYSA-N
MW223.24 g/mol
LogP2.19
Rot. Bonds2

About pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone

pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone (PubChem CID 59506817) has the molecular formula C13H9N3O and a molecular weight of 223.24 g/mol. Its IUPAC name is pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone.

Molecular Properties

Compound Namepyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
PubChem CID59506817
Molecular FormulaC13H9N3O
Molecular Weight223.24 g/mol
Exact Mass223.07
IUPAC Namepyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
SMILESO=C(c1ccccn1)c1c[nH]c2ncccc12
InChIInChI=1S/C13H9N3O/c17-12(11-5-1-2-6-14-11)10-8-16-13-9(10)4-3-7-15-13/h1-8H,(H,15,16)
InChIKeyGVEBBOSRLRCYOI-UHFFFAOYSA-N
XLogP2.19
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

bis(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 151992527
phenyl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 10998603
1H-indol-3-yl(pyridin-2-yl)methanone
CID 3820978
(2-chlorophenyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 43339358
(2-chloro-3-pyridinyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 59506825
1H-pyrrolo[2,3-b]pyridin-3-yl-(3,4,5-trifluorophenyl)methanone
CID 63187542
2-chloro-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)ethanone
CID 12778217
(4-tert-butylphenyl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 43339406
[2-(difluoromethoxy)phenyl]-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 43339376
2,2-dimethyl-1-(1H-pyrrolo[2,3-b]pyridin-3-yl)propan-1-one
CID 43161303
(2-methylfuran-3-yl)-(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone
CID 43463223
4-(1H-pyrrolo[2,3-b]pyridine-3-carbonyl)-1H-imidazole-5-carboxylic acid
CID 116520147

Frequently Asked Questions

What is the IUPAC name of pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone?
The IUPAC name of pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone (CID 59506817) is pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone.
What is the SMILES notation for pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone?
The canonical SMILES for pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone is O=C(c1ccccn1)c1c[nH]c2ncccc12.
What is the InChIKey of pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone?
The InChIKey is GVEBBOSRLRCYOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O/c17-12(11-5-1-2-6-14-11)10-8-16-13-9(10)4-3-7-15-13/h1-8H,(H,15,16).
What are the key properties of pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone?
pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone has a molecular weight of 223.24 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-2-yl(1H-pyrrolo[2,3-b]pyridin-3-yl)methanone is sourced from PubChem (CID 59506817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).