6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide

C21H19F5N4O3 — CID 171552864

IUPAC6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1c(C(=O)NC2(C)CC(F)(F)C2)nc2ccc(Oc3ncc(F)cc3OCC(F)F)cn12
InChIInChI=1S/C21H19F5N4O3/c1-11-17(18(31)29-20(2)9-21(25,26)10-20)28-16-4-3-13(7-30(11)16)33-19-14(32-8-15(23)24)5-12(22)6-27-19/h3-7,15H,8-10H2,1-2H3,(H,29,31)
InChIKeyNBOYGILYHYBMGA-UHFFFAOYSA-N
MW470.40 g/mol
LogP4.53
Rot. Bonds7

About 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide

6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 171552864) has the molecular formula C21H19F5N4O3 and a molecular weight of 470.40 g/mol. Its IUPAC name is 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide
PubChem CID171552864
Molecular FormulaC21H19F5N4O3
Molecular Weight470.40 g/mol
Exact Mass470.14
IUPAC Name6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1c(C(=O)NC2(C)CC(F)(F)C2)nc2ccc(Oc3ncc(F)cc3OCC(F)F)cn12
InChIInChI=1S/C21H19F5N4O3/c1-11-17(18(31)29-20(2)9-21(25,26)10-20)28-16-4-3-13(7-30(11)16)33-19-14(32-8-15(23)24)5-12(22)6-27-19/h3-7,15H,8-10H2,1-2H3,(H,29,31)
InChIKeyNBOYGILYHYBMGA-UHFFFAOYSA-N
XLogP4.53
TPSA77.75 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.40
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide with MolForge

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Related Compounds

6-[(5-fluoro-3-pyridinyl)oxy]-N-(6-methyl-2-pyridinyl)imidazo[1,2-a]pyridine-8-carboxamide
CID 118103886
N-{[2-(morpholin-4-ylcarbonyl)imidazo[1,2-a]pyridin-3-yl]methyl}-2-(pyridin-3-yloxy)ethanamine
CID 16188500
N-ethyl-5-[8-[(4-fluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]pyridine-2-carboxamide;hydrochloride
CID 156011213
N-ethyl-5-[8-[(2-fluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]pyridine-2-carboxamide;hydrochloride
CID 156016569
N-ethyl-5-[8-[(3-fluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridin-3-yl]pyridine-2-carboxamide;hydrochloride
CID 156018940
2,6-dimethyl-N-(2-phenoxyethyl)imidazo[1,2-a]pyridine-3-carboxamide
CID 134156917
[8-Methoxy-2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]-piperidin-1-ylmethanone
CID 122196570
8-[(2,6-difluorobenzyl)oxy]-N-{(2R)-2-[2-(difluoromethyl)-2H-tetrazol-5-yl]-1-hydroxypropan-2-yl}-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 74763521
8-[(2,6-difluorophenyl)methoxy]-N-[(2R)-1-hydroxy-2-phenylpropan-2-yl]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 118321196
US10526336, Example 15
CID 121439335
US10526336, Example 64
CID 121439813
US10526336, Example 16
CID 121439838

Frequently Asked Questions

What is the IUPAC name of 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide (CID 171552864) is 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide is Cc1c(C(=O)NC2(C)CC(F)(F)C2)nc2ccc(Oc3ncc(F)cc3OCC(F)F)cn12.
What is the InChIKey of 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is NBOYGILYHYBMGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19F5N4O3/c1-11-17(18(31)29-20(2)9-21(25,26)10-20)28-16-4-3-13(7-30(11)16)33-19-14(32-8-15(23)24)5-12(22)6-27-19/h3-7,15H,8-10H2,1-2H3,(H,29,31).
What are the key properties of 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide?
6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 470.40 g/mol, XLogP of 4.53, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[3-(2,2-difluoroethoxy)-5-fluoro-2-pyridinyl]oxy]-N-(3,3-difluoro-1-methylcyclobutyl)-3-methylimidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 171552864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).