1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone

C10H10N2O2 — CID 141368874

IUPAC1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone
SMILESCOc1ccc2ccn(C(C)=O)c2n1
InChIInChI=1S/C10H10N2O2/c1-7(13)12-6-5-8-3-4-9(14-2)11-10(8)12/h3-6H,1-2H3
InChIKeyDITVHNDIPJXWHR-UHFFFAOYSA-N
MW190.20 g/mol
LogP1.71
Rot. Bonds1

About 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone

1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone (PubChem CID 141368874) has the molecular formula C10H10N2O2 and a molecular weight of 190.20 g/mol. Its IUPAC name is 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone.

Molecular Properties

Compound Name1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone
PubChem CID141368874
Molecular FormulaC10H10N2O2
Molecular Weight190.20 g/mol
Exact Mass190.07
IUPAC Name1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone
SMILESCOc1ccc2ccn(C(C)=O)c2n1
InChIInChI=1S/C10H10N2O2/c1-7(13)12-6-5-8-3-4-9(14-2)11-10(8)12/h3-6H,1-2H3
InChIKeyDITVHNDIPJXWHR-UHFFFAOYSA-N
XLogP1.71
TPSA44.12 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.20
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(6-chloropyrrolo[2,3-b]pyridin-1-yl)ethanone
CID 141368895
N-[2-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethyl]acetamide
CID 52918077
1-(5-hydroxypyrrolo[2,3-b]pyridin-1-yl)ethanone
CID 27274720
5-methoxypyrazolo[1,5-a]pyrimidine-3-carboxylic acid
CID 121208399
6-methoxy-1-phenylpyrrolo[2,3-b]pyridine;6-methoxy-1H-pyrrolo[2,3-b]pyridine
CID 68736718
1-(2,4-dimethoxypyrrolo[3,2-d]pyrimidin-5-yl)ethanone
CID 641091
1-(5-methoxy-6-methylsulfanylindol-1-yl)ethanone
CID 71072893
1-(3-aminopropyl)-7-methoxy-1,8-naphthyridin-2-one
CID 145350680
1-indol-1-ylethanone;hydrochloride
CID 21333501
6-methoxypyridine-2-carbonyl chloride
CID 86688296
1-[6-methoxy-3-(methylamino)-2-pyridinyl]ethanone
CID 58772711
1-[6-(difluoromethoxy)indol-1-yl]ethanone
CID 141341359

Frequently Asked Questions

What is the IUPAC name of 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone?
The IUPAC name of 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone (CID 141368874) is 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone.
What is the SMILES notation for 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone?
The canonical SMILES for 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone is COc1ccc2ccn(C(C)=O)c2n1.
What is the InChIKey of 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone?
The InChIKey is DITVHNDIPJXWHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2/c1-7(13)12-6-5-8-3-4-9(14-2)11-10(8)12/h3-6H,1-2H3.
What are the key properties of 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone?
1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone has a molecular weight of 190.20 g/mol, XLogP of 1.71, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methoxypyrrolo[2,3-b]pyridin-1-yl)ethanone is sourced from PubChem (CID 141368874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).