2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide

C111H97F12N41O12S — CID 159332933

IUPAC2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide
SMILESCC(F)(F)C(=O)Nc1cccc(COC2=C(c3ccccc3)n3nnnc3C2)n1.CC(F)(F)C(=O)Nc1cccc(COc2cn3nnnc3n2-c2ccccc2)n1.Cn1nnnc1-c1c(OCc2cccc(NC(=O)C(C)(F)F)n2)[nH]c2ccccc12.Cn1nnnc1-n1c(OCc2cccc(NC(=O)C(C)(F)F)n2)cc2ccccc21.Cn1nnnc1-n1c(OCc2cccc(NC(=O)C(C)(F)F)n2)nc2ccccc21.Cn1nnnc1C1=C(OCc2csc(NC(=O)C(C)(F)F)n2)Cc2ccccc21
InChIInChI=1S/2C19H17F2N7O2.C19H16F2N6O2.C18H16F2N8O2.C18H15F2N7O2.C18H16F2N6O2S/c1-19(20,21)18(29)24-14-9-5-6-11(22-14)10-30-17-15(16-25-26-27-28(16)2)12-7-3-4-8-13(12)23-17;1-19(20,21)17(29)23-15-9-5-7-13(22-15)11-30-16-10-12-6-3-4-8-14(12)28(16)18-24-25-26-27(18)2;1-19(20,21)18(28)23-15-9-5-8-13(22-15)11-29-14-10-16-24-25-26-27(16)17(14)12-6-3-2-4-7-12;1-18(19,20)15(29)23-14-9-5-6-11(21-14)10-30-17-22-12-7-3-4-8-13(12)28(17)16-24-25-26-27(16)2;1-18(19,20)16(28)22-14-9-5-6-12(21-14)11-29-15-10-26-17(23-24-25-26)27(15)13-7-3-2-4-8-13;1-18(19,20)16(27)22-17-21-11(9-29-17)8-28-13-7-10-5-3-4-6-12(10)14(13)15-23-24-25-26(15)2/h3-9,23H,10H2,1-2H3,(H,22,24,29);3-10H,11H2,1-2H3,(H,22,23,29);2-9H,10-11H2,1H3,(H,22,23,28);3-9H,10H2,1-2H3,(H,21,23,29);2-10H,11H2,1H3,(H,21,22,28);3-6,9H,7-8H2,1-2H3,(H,21,22,27)
InChIKeyLFEHZQYTYPUEQF-UHFFFAOYSA-N
MW2457.31 g/mol
LogP15.69
Rot. Bonds36

About 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide

2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide (PubChem CID 159332933) has the molecular formula C111H97F12N41O12S and a molecular weight of 2457.31 g/mol. Its IUPAC name is 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide.

Molecular Properties

Compound Name2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide
PubChem CID159332933
Molecular FormulaC111H97F12N41O12S
Molecular Weight2457.31 g/mol
Exact Mass2455.78
IUPAC Name2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide
SMILESCC(F)(F)C(=O)Nc1cccc(COC2=C(c3ccccc3)n3nnnc3C2)n1.CC(F)(F)C(=O)Nc1cccc(COc2cn3nnnc3n2-c2ccccc2)n1.Cn1nnnc1-c1c(OCc2cccc(NC(=O)C(C)(F)F)n2)[nH]c2ccccc12.Cn1nnnc1-n1c(OCc2cccc(NC(=O)C(C)(F)F)n2)cc2ccccc21.Cn1nnnc1-n1c(OCc2cccc(NC(=O)C(C)(F)F)n2)nc2ccccc21.Cn1nnnc1C1=C(OCc2csc(NC(=O)C(C)(F)F)n2)Cc2ccccc21
InChIInChI=1S/2C19H17F2N7O2.C19H16F2N6O2.C18H16F2N8O2.C18H15F2N7O2.C18H16F2N6O2S/c1-19(20,21)18(29)24-14-9-5-6-11(22-14)10-30-17-15(16-25-26-27-28(16)2)12-7-3-4-8-13(12)23-17;1-19(20,21)17(29)23-15-9-5-7-13(22-15)11-30-16-10-12-6-3-4-8-14(12)28(16)18-24-25-26-27(18)2;1-19(20,21)18(28)23-15-9-5-8-13(22-15)11-29-14-10-16-24-25-26-27(16)17(14)12-6-3-2-4-7-12;1-18(19,20)15(29)23-14-9-5-6-11(21-14)10-30-17-22-12-7-3-4-8-13(12)28(17)16-24-25-26-27(16)2;1-18(19,20)16(28)22-14-9-5-6-12(21-14)11-29-15-10-26-17(23-24-25-26)27(15)13-7-3-2-4-8-13;1-18(19,20)16(27)22-17-21-11(9-29-17)8-28-13-7-10-5-3-4-6-12(10)14(13)15-23-24-25-26(15)2/h3-9,23H,10H2,1-2H3,(H,22,24,29);3-10H,11H2,1-2H3,(H,22,23,29);2-9H,10-11H2,1H3,(H,22,23,28);3-9H,10H2,1-2H3,(H,21,23,29);2-10H,11H2,1H3,(H,21,22,28);3-6,9H,7-8H2,1-2H3,(H,21,22,27)
InChIKeyLFEHZQYTYPUEQF-UHFFFAOYSA-N
XLogP15.69
TPSA611.87 Ų
H-Bond Donors7
H-Bond Acceptors47
Rotatable Bonds36
Heavy Atoms177
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002457.31
LogP ≤ 515.69
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1047

Analyze 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide with MolForge

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Related Compounds

CID 157901487
CID 157901487
2,2-difluoro-N-[6-[(5-phenylimidazo[4,5-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(5-phenylimidazo[4,5-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[(5-phenylpyrrolo[3,2-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(7-phenylpyrrolo[2,3-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(5-phenylpyrrolo[3,2-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(7-phenylpyrrolo[2,3-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide
CID 159046144
2,2-difluoro-N-[6-[[1-(3-methyl-2-pyridinyl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]-2-phenoxyacetamide;2,2-difluoro-N-[6-[(5-phenylpyrrolo[3,2-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(7-phenylpyrrolo[2,3-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(5-phenylpyrrolo[3,2-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(7-phenylpyrrolo[2,3-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]acetamide
CID 159324249
2,2-difluoro-N-[4-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[(5-phenyltetrazolo[1,5-a]pyridin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(5-phenyltetrazolo[1,5-a]pyridin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide
CID 160301675
2,2-difluoro-N-[4-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[(7-phenylimidazo[4,5-d]triazin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(7-phenylimidazo[4,5-d]triazin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[4-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[(5-phenyltetrazolo[1,5-a]pyridin-6-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[(5-phenyltetrazolo[1,5-a]pyridin-6-yl)oxymethyl]-1,3-thiazol-2-yl]propanamide
CID 160415314
2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide
CID 161441171
N-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-7-yl)-2-methylpropanamide;N-(6-fluoro-1,3-benzothiazol-2-yl)-2-methylpropanamide;N-(5-fluoro-2-pyridinyl)-2-methylpropanamide;N-(5-fluoro-3-pyridinyl)-2-methylpropanamide;N-isoquinolin-5-yl-2-methylpropanamide;2-methyl-N-(4-methyl-2-pyridinyl)propanamide;2-methyl-N-(5-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-3-pyridinyl)propanamide;2-methyl-N-(6-methyl-[1,3]thiazolo[3,2-b][1,2,4]triazol-2-yl)propanamide;2-methyl-N-(7H-purin-6-yl)propanamide;2-methyl-N-pyridazin-3-ylpropanamide;2-methyl-N-pyridazin-4-ylpropanamide;2-methyl-N-pyridin-2-ylpropanamide;2-methyl-N-pyridin-3-ylpropanamide;2-methyl-N-(1,2,4-triazin-5-yl)propanamide;2-methyl-N-(2H-triazolo[4,5-d]pyrimidin-7-yl)propanamide
CID 158166013

Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide?
The IUPAC name of 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide (CID 159332933) is 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide.
What is the SMILES notation for 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide?
The canonical SMILES for 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide is CC(F)(F)C(=O)Nc1cccc(COC2=C(c3ccccc3)n3nnnc3C2)n1.CC(F)(F)C(=O)Nc1cccc(COc2cn3nnnc3n2-c2ccccc2)n1.Cn1nnnc1-c1c(OCc2cccc(NC(=O)C(C)(F)F)n2)[nH]c2ccccc12.Cn1nnnc1-n1c(OCc2cccc(NC(=O)C(C)(F)F)n2)cc2ccccc21.Cn1nnnc1-n1c(OCc2cccc(NC(=O)C(C)(F)F)n2)nc2ccccc21.Cn1nnnc1C1=C(OCc2csc(NC(=O)C(C)(F)F)n2)Cc2ccccc21.
What is the InChIKey of 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide?
The InChIKey is LFEHZQYTYPUEQF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C19H17F2N7O2.C19H16F2N6O2.C18H16F2N8O2.C18H15F2N7O2.C18H16F2N6O2S/c1-19(20,21)18(29)24-14-9-5-6-11(22-14)10-30-17-15(16-25-26-27-28(16)2)12-7-3-4-8-13(12)23-17;1-19(20,21)17(29)23-15-9-5-7-13(22-15)11-30-16-10-12-6-3-4-8-14(12)28(16)18-24-25-26-27(18)2;1-19(20,21)18(28)23-15-9-5-8-13(22-15)11-29-14-10-16-24-25-26-27(16)17(14)12-6-3-2-4-7-12;1-18(19,20)15(29)23-14-9-5-6-11(21-14)10-30-17-22-12-7-3-4-8-13(12)28(17)16-24-25-26-27(16)2;1-18(19,20)16(28)22-14-9-5-6-12(21-14)11-29-15-10-26-17(23-24-25-26)27(15)13-7-3-2-4-8-13;1-18(19,20)16(27)22-17-21-11(9-29-17)8-28-13-7-10-5-3-4-6-12(10)14(13)15-23-24-25-26(15)2/h3-9,23H,10H2,1-2H3,(H,22,24,29);3-10H,11H2,1-2H3,(H,22,23,29);2-9H,10-11H2,1H3,(H,22,23,28);3-9H,10H2,1-2H3,(H,21,23,29);2-10H,11H2,1H3,(H,21,22,28);3-6,9H,7-8H2,1-2H3,(H,21,22,27).
What are the key properties of 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide?
2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide has a molecular weight of 2457.31 g/mol, XLogP of 15.69, 36 rotatable bonds, 7 hydrogen bond donors, and 47 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)benzimidazol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[4-[[3-(1-methyltetrazol-5-yl)-1H-inden-2-yl]oxymethyl]-1,3-thiazol-2-yl]propanamide;2,2-difluoro-N-[6-[[1-(1-methyltetrazol-5-yl)indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[[3-(1-methyltetrazol-5-yl)-1H-indol-2-yl]oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(4-phenylimidazo[2,1-e]tetrazol-5-yl)oxymethyl]-2-pyridinyl]propanamide;2,2-difluoro-N-[6-[(5-phenyl-7H-pyrrolo[2,1-e]tetrazol-6-yl)oxymethyl]-2-pyridinyl]propanamide is sourced from PubChem (CID 159332933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).