6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine

C16H14ClF2N3O2 — CID 171655426

IUPAC6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine
SMILESCc1cc2ccc(Oc3ncc(Cl)cc3OCC(F)F)nc2n1C
InChIInChI=1S/C16H14ClF2N3O2/c1-9-5-10-3-4-14(21-15(10)22(9)2)24-16-12(23-8-13(18)19)6-11(17)7-20-16/h3-7,13H,8H2,1-2H3
InChIKeyPDVOGGNTKLGGIE-UHFFFAOYSA-N
MW353.76 g/mol
LogP4.37
Rot. Bonds5

About 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine

6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine (PubChem CID 171655426) has the molecular formula C16H14ClF2N3O2 and a molecular weight of 353.76 g/mol. Its IUPAC name is 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine
PubChem CID171655426
Molecular FormulaC16H14ClF2N3O2
Molecular Weight353.76 g/mol
Exact Mass353.07
IUPAC Name6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine
SMILESCc1cc2ccc(Oc3ncc(Cl)cc3OCC(F)F)nc2n1C
InChIInChI=1S/C16H14ClF2N3O2/c1-9-5-10-3-4-14(21-15(10)22(9)2)24-16-12(23-8-13(18)19)6-11(17)7-20-16/h3-7,13H,8H2,1-2H3
InChIKeyPDVOGGNTKLGGIE-UHFFFAOYSA-N
XLogP4.37
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.76
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine with MolForge

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Related Compounds

1-[(4-Propan-2-yloxyphenyl)methyl]-4-[[2-(trifluoromethyl)pyrrolo[2,3-b]pyridin-1-yl]methyl]piperidin-4-ol
CID 92580325
3-Chloro-8-(2,6-dichlorobenzyloxy)-2-methylimidazo[1,2-a]pyridine
CID 10569271
8-Chloro-7-[4-[(2,6-dimethyl-3-pyridinyl)oxy]-3-fluorophenyl]-3-(ethoxymethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 66786816
2-(4-Fluorophenyl)-6-methyl-3-[3-[(6-methyl-3-pyridyl)oxy]propoxy]imidazo[1,2-a]pyridine
CID 137632320
3-[2-(4-Fluorophenoxy)ethoxy]-2-(4-fluorophenyl)-6-methyl-imidazo[1,2-a]pyridine
CID 137634206
6-Chloro-3-[2-(4-fluorophenoxy)ethoxy]-2-phenyl-imidazo[1,2-a]pyridine
CID 137637246
2-(4-Fluorophenyl)-3-[3-[(5-fluoro-3-pyridyl)oxy]propoxy]-6-methyl-imidazo[1,2-a]pyridine
CID 137641856
6-Chloro-3-(3-phenoxypropoxy)-2-phenyl-imidazo[1,2-a]pyridine
CID 137642608
2-(4-Fluorophenyl)-6-methyl-3-[3-(3-pyridyloxy)propoxy]imidazo[1,2-a]pyridine
CID 137653069
3-[3-[(2,6-Dimethyl-3-pyridyl)oxy]propoxy]-2-(4-fluorophenyl)-6-methyl-imidazo[1,2-a]pyridine
CID 137653408
3-[1-(2-Chloro-5-fluorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-6-ylpyridin-2-amine
CID 156015679
3-Chloro-8-(2,6-difluoro-benzyloxy)-2-methyl-imidazo[1,2-a]pyridine
CID 10518915

Frequently Asked Questions

What is the IUPAC name of 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine?
The IUPAC name of 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine (CID 171655426) is 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine.
What is the SMILES notation for 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine?
The canonical SMILES for 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine is Cc1cc2ccc(Oc3ncc(Cl)cc3OCC(F)F)nc2n1C.
What is the InChIKey of 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine?
The InChIKey is PDVOGGNTKLGGIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClF2N3O2/c1-9-5-10-3-4-14(21-15(10)22(9)2)24-16-12(23-8-13(18)19)6-11(17)7-20-16/h3-7,13H,8H2,1-2H3.
What are the key properties of 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine?
6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine has a molecular weight of 353.76 g/mol, XLogP of 4.37, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[5-chloro-3-(2,2-difluoroethoxy)-2-pyridinyl]oxy]-1,2-dimethylpyrrolo[2,3-b]pyridine is sourced from PubChem (CID 171655426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).