1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

C245H251N43O28 — CID 158365930

IUPAC1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
SMILESCC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(-n5ccnc5)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(C#N)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(Cn5cncn5)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc5cnn(C)c5c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc5ncccc5c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4cnn(C)c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc4nc(-c5cccnc5)oc34)nn2C2CCOCC2)C1.COc1ccc(-c2cn3c(-c4nn(C5CCOCC5)c5c4CN(C(C)=O)CC5)cccc3n2)cc1.COc1ccc(-c2nc3cccc(-c4nn(C5CCOCC5)c5c4CN(C(C)=O)CC5)c3o2)cc1
InChIInChI=1S/C29H30N6O3.C29H29N5O3.C29H28N4O3.C28H29N5O3.C27H29N5O3.C27H28N4O4.C27H26N4O3.C25H25N5O3.C24H27N5O3/c1-20(36)33-11-9-27-26(16-33)29(32-35(27)25-10-12-38-17-25)24-4-2-3-23(14-24)28(37)13-21-5-7-22(8-6-21)15-34-19-30-18-31-34;1-20(35)32-12-9-27-26(17-32)29(31-34(27)25-10-14-37-18-25)23-4-2-3-22(16-23)28(36)15-21-5-7-24(8-6-21)33-13-11-30-19-33;1-19(34)32-12-9-27-25(17-32)29(31-33(27)24-10-13-36-18-24)23-5-2-4-22(16-23)28(35)15-20-7-8-26-21(14-20)6-3-11-30-26;1-18(34)32-10-8-25-24(16-32)28(30-33(25)23-9-11-36-17-23)21-5-3-4-20(14-21)27(35)13-19-6-7-22-15-29-31(2)26(22)12-19;1-18(33)30-13-10-24-22(16-30)27(29-32(24)20-11-14-35-15-12-20)25-4-3-5-26-28-23(17-31(25)26)19-6-8-21(34-2)9-7-19;1-17(32)30-13-10-24-22(16-30)25(29-31(24)19-11-14-34-15-12-19)21-4-3-5-23-26(21)35-27(28-23)18-6-8-20(33-2)9-7-18;1-18(32)30-11-9-25-24(16-30)27(29-31(25)23-10-12-34-17-23)22-4-2-3-21(14-22)26(33)13-19-5-7-20(15-28)8-6-19;1-16(31)29-11-7-22-20(15-29)23(28-30(22)18-8-12-32-13-9-18)19-5-2-6-21-24(19)33-25(27-21)17-4-3-10-26-14-17;1-16(30)28-8-6-22-21(14-28)24(26-29(22)20-7-9-32-15-20)19-5-3-4-18(11-19)23(31)10-17-12-25-27(2)13-17/h2-8,14,18-19,25H,9-13,15-17H2,1H3;2-8,11,13,16,19,25H,9-10,12,14-15,17-18H2,1H3;2-8,11,14,16,24H,9-10,12-13,15,17-18H2,1H3;3-7,12,14-15,23H,8-11,13,16-17H2,1-2H3;3-9,17,20H,10-16H2,1-2H3;3-9,19H,10-16H2,1-2H3;2-8,14,23H,9-13,16-17H2,1H3;2-6,10,14,18H,7-9,11-13,15H2,1H3;3-5,11-13,20H,6-10,14-15H2,1-2H3
InChIKeyGUAJGEYAUKRKIW-UHFFFAOYSA-N
MW4245.98 g/mol
LogP34.68
Rot. Bonds44

About 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone

1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (PubChem CID 158365930) has the molecular formula C245H251N43O28 and a molecular weight of 4245.98 g/mol. Its IUPAC name is 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.

Molecular Properties

Compound Name1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
PubChem CID158365930
Molecular FormulaC245H251N43O28
Molecular Weight4245.98 g/mol
Exact Mass4242.95
IUPAC Name1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone
SMILESCC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(-n5ccnc5)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(C#N)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(Cn5cncn5)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc5cnn(C)c5c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc5ncccc5c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4cnn(C)c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc4nc(-c5cccnc5)oc34)nn2C2CCOCC2)C1.COc1ccc(-c2cn3c(-c4nn(C5CCOCC5)c5c4CN(C(C)=O)CC5)cccc3n2)cc1.COc1ccc(-c2nc3cccc(-c4nn(C5CCOCC5)c5c4CN(C(C)=O)CC5)c3o2)cc1
InChIInChI=1S/C29H30N6O3.C29H29N5O3.C29H28N4O3.C28H29N5O3.C27H29N5O3.C27H28N4O4.C27H26N4O3.C25H25N5O3.C24H27N5O3/c1-20(36)33-11-9-27-26(16-33)29(32-35(27)25-10-12-38-17-25)24-4-2-3-23(14-24)28(37)13-21-5-7-22(8-6-21)15-34-19-30-18-31-34;1-20(35)32-12-9-27-26(17-32)29(31-34(27)25-10-14-37-18-25)23-4-2-3-22(16-23)28(36)15-21-5-7-24(8-6-21)33-13-11-30-19-33;1-19(34)32-12-9-27-25(17-32)29(31-33(27)24-10-13-36-18-24)23-5-2-4-22(16-23)28(35)15-20-7-8-26-21(14-20)6-3-11-30-26;1-18(34)32-10-8-25-24(16-32)28(30-33(25)23-9-11-36-17-23)21-5-3-4-20(14-21)27(35)13-19-6-7-22-15-29-31(2)26(22)12-19;1-18(33)30-13-10-24-22(16-30)27(29-32(24)20-11-14-35-15-12-20)25-4-3-5-26-28-23(17-31(25)26)19-6-8-21(34-2)9-7-19;1-17(32)30-13-10-24-22(16-30)25(29-31(24)19-11-14-34-15-12-19)21-4-3-5-23-26(21)35-27(28-23)18-6-8-20(33-2)9-7-18;1-18(32)30-11-9-25-24(16-30)27(29-31(25)23-10-12-34-17-23)22-4-2-3-21(14-22)26(33)13-19-5-7-20(15-28)8-6-19;1-16(31)29-11-7-22-20(15-29)23(28-30(22)18-8-12-32-13-9-18)19-5-2-6-21-24(19)33-25(27-21)17-4-3-10-26-14-17;1-16(30)28-8-6-22-21(14-28)24(26-29(22)20-7-9-32-15-20)19-5-3-4-18(11-19)23(31)10-17-12-25-27(2)13-17/h2-8,14,18-19,25H,9-13,15-17H2,1H3;2-8,11,13,16,19,25H,9-10,12,14-15,17-18H2,1H3;2-8,11,14,16,24H,9-10,12-13,15,17-18H2,1H3;3-7,12,14-15,23H,8-11,13,16-17H2,1-2H3;3-9,17,20H,10-16H2,1-2H3;3-9,19H,10-16H2,1-2H3;2-8,14,23H,9-13,16-17H2,1H3;2-6,10,14,18H,7-9,11-13,15H2,1H3;3-5,11-13,20H,6-10,14-15H2,1-2H3
InChIKeyGUAJGEYAUKRKIW-UHFFFAOYSA-N
XLogP34.68
TPSA750.22 Ų
H-Bond Donors
H-Bond Acceptors62
Rotatable Bonds44
Heavy Atoms316
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004245.98
LogP ≤ 534.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1062

Analyze 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone with MolForge

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What is the IUPAC name of 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?
The IUPAC name of 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone (CID 158365930) is 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone.
What is the SMILES notation for 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?
The canonical SMILES for 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(-n5ccnc5)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(C#N)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc(Cn5cncn5)cc4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc5cnn(C)c5c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4ccc5ncccc5c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc(C(=O)Cc4cnn(C)c4)c3)nn2C2CCOC2)C1.CC(=O)N1CCc2c(c(-c3cccc4nc(-c5cccnc5)oc34)nn2C2CCOCC2)C1.COc1ccc(-c2cn3c(-c4nn(C5CCOCC5)c5c4CN(C(C)=O)CC5)cccc3n2)cc1.COc1ccc(-c2nc3cccc(-c4nn(C5CCOCC5)c5c4CN(C(C)=O)CC5)c3o2)cc1.
What is the InChIKey of 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?
The InChIKey is GUAJGEYAUKRKIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H30N6O3.C29H29N5O3.C29H28N4O3.C28H29N5O3.C27H29N5O3.C27H28N4O4.C27H26N4O3.C25H25N5O3.C24H27N5O3/c1-20(36)33-11-9-27-26(16-33)29(32-35(27)25-10-12-38-17-25)24-4-2-3-23(14-24)28(37)13-21-5-7-22(8-6-21)15-34-19-30-18-31-34;1-20(35)32-12-9-27-26(17-32)29(31-34(27)25-10-14-37-18-25)23-4-2-3-22(16-23)28(36)15-21-5-7-24(8-6-21)33-13-11-30-19-33;1-19(34)32-12-9-27-25(17-32)29(31-33(27)24-10-13-36-18-24)23-5-2-4-22(16-23)28(35)15-20-7-8-26-21(14-20)6-3-11-30-26;1-18(34)32-10-8-25-24(16-32)28(30-33(25)23-9-11-36-17-23)21-5-3-4-20(14-21)27(35)13-19-6-7-22-15-29-31(2)26(22)12-19;1-18(33)30-13-10-24-22(16-30)27(29-32(24)20-11-14-35-15-12-20)25-4-3-5-26-28-23(17-31(25)26)19-6-8-21(34-2)9-7-19;1-17(32)30-13-10-24-22(16-30)25(29-31(24)19-11-14-34-15-12-19)21-4-3-5-23-26(21)35-27(28-23)18-6-8-20(33-2)9-7-18;1-18(32)30-11-9-25-24(16-30)27(29-31(25)23-10-12-34-17-23)22-4-2-3-21(14-22)26(33)13-19-5-7-20(15-28)8-6-19;1-16(31)29-11-7-22-20(15-29)23(28-30(22)18-8-12-32-13-9-18)19-5-2-6-21-24(19)33-25(27-21)17-4-3-10-26-14-17;1-16(30)28-8-6-22-21(14-28)24(26-29(22)20-7-9-32-15-20)19-5-3-4-18(11-19)23(31)10-17-12-25-27(2)13-17/h2-8,14,18-19,25H,9-13,15-17H2,1H3;2-8,11,13,16,19,25H,9-10,12,14-15,17-18H2,1H3;2-8,11,14,16,24H,9-10,12-13,15,17-18H2,1H3;3-7,12,14-15,23H,8-11,13,16-17H2,1-2H3;3-9,17,20H,10-16H2,1-2H3;3-9,19H,10-16H2,1-2H3;2-8,14,23H,9-13,16-17H2,1H3;2-6,10,14,18H,7-9,11-13,15H2,1H3;3-5,11-13,20H,6-10,14-15H2,1-2H3.
What are the key properties of 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone?
1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone has a molecular weight of 4245.98 g/mol, XLogP of 34.68, 44 rotatable bonds, 0 hydrogen bond donors, and 62 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(4-imidazol-1-ylphenyl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylindazol-6-yl)ethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-(1-methylpyrazol-4-yl)ethanone;4-[2-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-oxoethyl]benzonitrile;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-quinolin-6-ylethanone;1-[3-[5-acetyl-1-(oxolan-3-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]phenyl]-2-[4-(1,2,4-triazol-1-ylmethyl)phenyl]ethanone;1-[3-[2-(4-methoxyphenyl)-1,3-benzoxazol-7-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[3-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-5-yl]-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone;1-[1-(oxan-4-yl)-3-(2-pyridin-3-yl-1,3-benzoxazol-7-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-5-yl]ethanone is sourced from PubChem (CID 158365930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).