3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine

C129H103F30N25O8 — CID 158123233

IUPAC3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine
SMILESCC(F)(F)c1cnn2ccc(-c3ccc(C4(C#N)CC4)cc3)nc12.CC(F)c1cnn2ccc(-c3ccc(C(F)(F)F)cc3)nc12.CC(F)c1cnn2ccc(-c3ccc(OC(F)(F)F)cc3)nc12.COC(C)(C)c1ccc(-c2ccn3ncc(C(C)(F)F)c3n2)cc1.COCc1cc(OC(F)(F)F)ccc1-c1ccn2ncc(C(C)(F)F)c2n1.COc1cc(OC(F)(F)F)ccc1-c1ccn2nccc2n1.Cc1cc(-c2ccn3ncc(C(C)(F)F)c3n2)ccc1OC(F)(F)F.Cc1cc(OC(F)(F)F)ccc1-c1ccn2ncc(C(C)(F)F)c2n1
InChIInChI=1S/C18H14F2N4.C18H19F2N3O.C17H14F5N3O2.2C16H12F5N3O.C15H11F4N3O.C15H11F4N3.C14H10F3N3O2/c1-17(19,20)14-10-22-24-9-6-15(23-16(14)24)12-2-4-13(5-3-12)18(11-21)7-8-18;1-17(2,24-4)13-7-5-12(6-8-13)15-9-10-23-16(22-15)14(11-21-23)18(3,19)20;1-16(18,19)13-8-23-25-6-5-14(24-15(13)25)12-4-3-11(27-17(20,21)22)7-10(12)9-26-2;1-9-7-10(3-4-13(9)25-16(19,20)21)12-5-6-24-14(23-12)11(8-22-24)15(2,17)18;1-9-7-10(25-16(19,20)21)3-4-11(9)13-5-6-24-14(23-13)12(8-22-24)15(2,17)18;1-9(16)12-8-20-22-7-6-13(21-14(12)22)10-2-4-11(5-3-10)23-15(17,18)19;1-9(16)12-8-20-22-7-6-13(21-14(12)22)10-2-4-11(5-3-10)15(17,18)19;1-21-12-8-9(22-14(15,16)17)2-3-10(12)11-5-7-20-13(19-11)4-6-18-20/h2-6,9-10H,7-8H2,1H3;5-11H,1-4H3;3-8H,9H2,1-2H3;2*3-8H,1-2H3;2-9H,1H3;2-9H,1H3;2-8H,1H3
InChIKeyFRVVKYKPKRWDKW-UHFFFAOYSA-N
MW2701.35 g/mol
LogP34.51
Rot. Bonds26

About 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine

3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine (PubChem CID 158123233) has the molecular formula C129H103F30N25O8 and a molecular weight of 2701.35 g/mol. Its IUPAC name is 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine
PubChem CID158123233
Molecular FormulaC129H103F30N25O8
Molecular Weight2701.35 g/mol
Exact Mass2699.79
IUPAC Name3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine
SMILESCC(F)(F)c1cnn2ccc(-c3ccc(C4(C#N)CC4)cc3)nc12.CC(F)c1cnn2ccc(-c3ccc(C(F)(F)F)cc3)nc12.CC(F)c1cnn2ccc(-c3ccc(OC(F)(F)F)cc3)nc12.COC(C)(C)c1ccc(-c2ccn3ncc(C(C)(F)F)c3n2)cc1.COCc1cc(OC(F)(F)F)ccc1-c1ccn2ncc(C(C)(F)F)c2n1.COc1cc(OC(F)(F)F)ccc1-c1ccn2nccc2n1.Cc1cc(-c2ccn3ncc(C(C)(F)F)c3n2)ccc1OC(F)(F)F.Cc1cc(OC(F)(F)F)ccc1-c1ccn2ncc(C(C)(F)F)c2n1
InChIInChI=1S/C18H14F2N4.C18H19F2N3O.C17H14F5N3O2.2C16H12F5N3O.C15H11F4N3O.C15H11F4N3.C14H10F3N3O2/c1-17(19,20)14-10-22-24-9-6-15(23-16(14)24)12-2-4-13(5-3-12)18(11-21)7-8-18;1-17(2,24-4)13-7-5-12(6-8-13)15-9-10-23-16(22-15)14(11-21-23)18(3,19)20;1-16(18,19)13-8-23-25-6-5-14(24-15(13)25)12-4-3-11(27-17(20,21)22)7-10(12)9-26-2;1-9-7-10(3-4-13(9)25-16(19,20)21)12-5-6-24-14(23-12)11(8-22-24)15(2,17)18;1-9-7-10(25-16(19,20)21)3-4-11(9)13-5-6-24-14(23-13)12(8-22-24)15(2,17)18;1-9(16)12-8-20-22-7-6-13(21-14(12)22)10-2-4-11(5-3-10)23-15(17,18)19;1-9(16)12-8-20-22-7-6-13(21-14(12)22)10-2-4-11(5-3-10)15(17,18)19;1-21-12-8-9(22-14(15,16)17)2-3-10(12)11-5-7-20-13(19-11)4-6-18-20/h2-6,9-10H,7-8H2,1H3;5-11H,1-4H3;3-8H,9H2,1-2H3;2*3-8H,1-2H3;2-9H,1H3;2-9H,1H3;2-8H,1H3
InChIKeyFRVVKYKPKRWDKW-UHFFFAOYSA-N
XLogP34.51
TPSA339.15 Ų
H-Bond Donors
H-Bond Acceptors33
Rotatable Bonds26
Heavy Atoms192
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002701.35
LogP ≤ 534.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1033

Analyze 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine with MolForge

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Related Compounds

3-(1,1-Difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;ethane;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[4-(2-methoxypropan-2-yl)phenyl]-3-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine
CID 142362599
N-(3,5-difluorophenyl)-8-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3,5-difluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-(3-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-(2-methyl-4-pyridinyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(3-methoxyphenyl)-N-pyridin-4-yl-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 157068880
1-[4-[6-(1,1-Difluoroethyl)imidazo[1,5-a]pyrimidin-3-yl]-3-methoxyphenyl]cyclopropane-1-carbonitrile;1-[4-[6-(1,1-difluoroethyl)imidazo[1,5-a]pyrimidin-3-yl]phenyl]cyclopropane-1-carbonitrile;bis(3-(1,1-difluoroethyl)-6-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]imidazo[1,5-a]pyrazine);3-(1,1-difluoroethyl)-6-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]imidazo[1,5-a]pyridine-1-carbonitrile;6-(1,1-difluoroethyl)-8-methyl-3-[4-(trifluoromethoxy)phenyl]imidazo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-6-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]imidazo[1,5-a]pyridine-1-carbonitrile;6-(1,1-difluoroethyl)-3-[4-(trifluoromethyl)phenyl]imidazo[1,5-a]pyrimidine
CID 157071658
3-[difluoro(methoxy)methyl]-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1-fluoroethyl)-6-[2-fluoro-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1-fluoroethyl)-6-[4-(2-methoxypropan-2-yl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1-fluoroethyl)-6-[2-methoxy-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1-fluoroethyl)-6-[2-methyl-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1-fluoroethyl)-6-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(2-fluoro-2-methylcyclopropyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[[(2S)-oxan-2-yl]methyl]-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-[[(2R)-oxan-2-yl]methyl]-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 157150882
6-(4-Cyclopropyl-2-methoxyphenyl)-3-(1,1-difluoroethyl)-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[2-fluoro-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[4-(2-methoxypropan-2-yl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[2-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[4-methyl-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;1-[4-[3-(1,1-difluoroethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]-3-methoxyphenyl]cyclopropane-1-carbonitrile;3-ethyl-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 157179546
6-[4-(1-Cyanocyclopropyl)phenyl]-3-(1,1-difluoroethyl)imidazo[1,5-a]pyridine-1-carbonitrile;3-(1,1-difluoroethyl)-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]imidazo[1,5-a]pyrazine;1-[4-[3-(1,1-difluoroethyl)imidazo[1,5-a]pyrazin-6-yl]phenyl]cyclopropane-1-carbonitrile;7-(1,1-difluoroethyl)-2-[4-(trifluoromethoxy)phenyl]imidazo[1,5-b]pyridazine-5-carbonitrile;3-(1-fluoroethyl)-6-[4-(trifluoromethoxy)phenyl]imidazo[1,5-a]pyridine-1-carbonitrile;6-(3-fluoro-3-methylcyclobutyl)-3-[4-(trifluoromethoxy)phenyl]imidazo[1,5-a]pyrimidine
CID 157183479
3-(1,1-Difluoroethyl)-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[2-methoxy-4-(2-methoxypropan-2-yl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1-difluoroethyl)-6-[2-(methoxymethyl)-4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-[difluoro(methoxy)methyl]-6-[2-methyl-4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1-fluorocyclopropyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;1-pyrrolidin-1-yl-2-[6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazin-3-yl]ethanone
CID 157255937
3-(1,1-Difluoroethyl)-6-[2-fluoro-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[2-fluoro-4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[2-methoxy-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine;3-(1,1-difluoroethyl)-6-[2-methyl-4-(trifluoromethyl)phenyl]-[1,2,4]triazolo[4,3-a]pyrazine
CID 157305654
N-(3,5-difluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-(3-methylphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine;8-(2-fluorophenyl)-N-phenyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(3-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(4-fluorophenyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-(2-methyl-4-pyridinyl)-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine;N-phenyl-8-[3-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 157307599
3-(1,1-Difluoroethyl)-6-[5-fluoro-6-(2,2,2-trifluoroethoxy)-3-pyridinyl]imidazo[1,2-a]pyrazine;1-[4-[3-(1,1-difluoroethyl)imidazo[1,2-a]pyrazin-6-yl]phenyl]cyclopropane-1-carbonitrile;3-(1,1-difluoroethyl)-6-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]imidazo[1,2-a]pyrazine;3-(1,1-difluoroethyl)-6-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyrazine;2-methyl-6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyrimidine
CID 157455809
CID 157477009
CID 157477009
3-Cyclopropyl-6-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine;1-[4-[3-(1,1-difluoroethyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]phenyl]cyclopropane-1-carbonitrile;3-(3-fluoro-3-methylcyclobutyl)-6-[2-methoxy-4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(oxolan-2-ylmethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(oxolan-3-ylmethyl)-6-[4-(trifluoromethoxy)phenyl]-[1,2,4]triazolo[4,3-b]pyridazine;3-(1,1,2,2-tetrafluoropropyl)-6-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]-[1,2,4]triazolo[4,3-b]pyridazine
CID 157478349

Frequently Asked Questions

What is the IUPAC name of 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine?
The IUPAC name of 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine (CID 158123233) is 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine.
What is the SMILES notation for 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine?
The canonical SMILES for 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine is CC(F)(F)c1cnn2ccc(-c3ccc(C4(C#N)CC4)cc3)nc12.CC(F)c1cnn2ccc(-c3ccc(C(F)(F)F)cc3)nc12.CC(F)c1cnn2ccc(-c3ccc(OC(F)(F)F)cc3)nc12.COC(C)(C)c1ccc(-c2ccn3ncc(C(C)(F)F)c3n2)cc1.COCc1cc(OC(F)(F)F)ccc1-c1ccn2ncc(C(C)(F)F)c2n1.COc1cc(OC(F)(F)F)ccc1-c1ccn2nccc2n1.Cc1cc(-c2ccn3ncc(C(C)(F)F)c3n2)ccc1OC(F)(F)F.Cc1cc(OC(F)(F)F)ccc1-c1ccn2ncc(C(C)(F)F)c2n1.
What is the InChIKey of 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine?
The InChIKey is FRVVKYKPKRWDKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14F2N4.C18H19F2N3O.C17H14F5N3O2.2C16H12F5N3O.C15H11F4N3O.C15H11F4N3.C14H10F3N3O2/c1-17(19,20)14-10-22-24-9-6-15(23-16(14)24)12-2-4-13(5-3-12)18(11-21)7-8-18;1-17(2,24-4)13-7-5-12(6-8-13)15-9-10-23-16(22-15)14(11-21-23)18(3,19)20;1-16(18,19)13-8-23-25-6-5-14(24-15(13)25)12-4-3-11(27-17(20,21)22)7-10(12)9-26-2;1-9-7-10(3-4-13(9)25-16(19,20)21)12-5-6-24-14(23-12)11(8-22-24)15(2,17)18;1-9-7-10(25-16(19,20)21)3-4-11(9)13-5-6-24-14(23-13)12(8-22-24)15(2,17)18;1-9(16)12-8-20-22-7-6-13(21-14(12)22)10-2-4-11(5-3-10)23-15(17,18)19;1-9(16)12-8-20-22-7-6-13(21-14(12)22)10-2-4-11(5-3-10)15(17,18)19;1-21-12-8-9(22-14(15,16)17)2-3-10(12)11-5-7-20-13(19-11)4-6-18-20/h2-6,9-10H,7-8H2,1H3;5-11H,1-4H3;3-8H,9H2,1-2H3;2*3-8H,1-2H3;2-9H,1H3;2-9H,1H3;2-8H,1H3.
What are the key properties of 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine?
3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine has a molecular weight of 2701.35 g/mol, XLogP of 34.51, 26 rotatable bonds, 0 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,1-difluoroethyl)-5-[2-(methoxymethyl)-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[4-(2-methoxypropan-2-yl)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[2-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1,1-difluoroethyl)-5-[3-methyl-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;1-[4-[3-(1,1-difluoroethyl)pyrazolo[1,5-a]pyrimidin-5-yl]phenyl]cyclopropane-1-carbonitrile;3-(1-fluoroethyl)-5-[4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine;3-(1-fluoroethyl)-5-[4-(trifluoromethyl)phenyl]pyrazolo[1,5-a]pyrimidine;5-[2-methoxy-4-(trifluoromethoxy)phenyl]pyrazolo[1,5-a]pyrimidine is sourced from PubChem (CID 158123233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).