1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one

C125H149F10N31O10 — CID 167676071

IUPAC1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one
SMILESCC(=O)CN1CCC(Cn2cnc3c(N(Cc4ccc(C(F)(F)F)cc4)C4CC4)ncnc32)C(O)C1.CCN(Cc1ccc(-n2cccn2)cc1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C#N)cc1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C(F)(F)F)cn1)c1ncnc2c1c(F)cn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C(F)(F)F)cn1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O
InChIInChI=1S/C27H33N7O2.C25H29F3N6O2.C25H30N6O2.C24H28F4N6O2.C24H29F3N6O2/c1-3-32(16-21-5-7-23(8-6-21)34-12-4-11-30-34)26-24-10-14-33(27(24)29-19-28-26)17-22-9-13-31(15-20(2)35)18-25(22)36;1-16(35)10-32-9-8-18(21(36)13-32)12-33-15-31-22-23(33)29-14-30-24(22)34(20-6-7-20)11-17-2-4-19(5-3-17)25(26,27)28;1-3-30(14-20-6-4-19(12-26)5-7-20)24-22-9-11-31(25(22)28-17-27-24)15-21-8-10-29(13-18(2)32)16-23(21)33;1-3-33(11-18-5-4-17(8-29-18)24(26,27)28)22-21-19(25)12-34(23(21)31-14-30-22)10-16-6-7-32(9-15(2)35)13-20(16)36;1-3-32(13-19-5-4-18(10-28-19)24(25,26)27)22-20-7-9-33(23(20)30-15-29-22)12-17-6-8-31(11-16(2)34)14-21(17)35/h4-8,10-12,14,19,22,25,36H,3,9,13,15-18H2,1-2H3;2-5,14-15,18,20-21,36H,6-13H2,1H3;4-7,9,11,17,21,23,33H,3,8,10,13-16H2,1-2H3;4-5,8,12,14,16,20,36H,3,6-7,9-11,13H2,1-2H3;4-5,7,9-10,15,17,21,35H,3,6,8,11-14H2,1-2H3
InChIKeyUVEKQYYKWFFQEF-UHFFFAOYSA-N
MW2435.75 g/mol
LogP15.23
Rot. Bonds41

About 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one

1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one (PubChem CID 167676071) has the molecular formula C125H149F10N31O10 and a molecular weight of 2435.75 g/mol. Its IUPAC name is 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one.

Molecular Properties

Compound Name1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one
PubChem CID167676071
Molecular FormulaC125H149F10N31O10
Molecular Weight2435.75 g/mol
Exact Mass2434.19
IUPAC Name1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one
SMILESCC(=O)CN1CCC(Cn2cnc3c(N(Cc4ccc(C(F)(F)F)cc4)C4CC4)ncnc32)C(O)C1.CCN(Cc1ccc(-n2cccn2)cc1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C#N)cc1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C(F)(F)F)cn1)c1ncnc2c1c(F)cn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C(F)(F)F)cn1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O
InChIInChI=1S/C27H33N7O2.C25H29F3N6O2.C25H30N6O2.C24H28F4N6O2.C24H29F3N6O2/c1-3-32(16-21-5-7-23(8-6-21)34-12-4-11-30-34)26-24-10-14-33(27(24)29-19-28-26)17-22-9-13-31(15-20(2)35)18-25(22)36;1-16(35)10-32-9-8-18(21(36)13-32)12-33-15-31-22-23(33)29-14-30-24(22)34(20-6-7-20)11-17-2-4-19(5-3-17)25(26,27)28;1-3-30(14-20-6-4-19(12-26)5-7-20)24-22-9-11-31(25(22)28-17-27-24)15-21-8-10-29(13-18(2)32)16-23(21)33;1-3-33(11-18-5-4-17(8-29-18)24(26,27)28)22-21-19(25)12-34(23(21)31-14-30-22)10-16-6-7-32(9-15(2)35)13-20(16)36;1-3-32(13-19-5-4-18(10-28-19)24(25,26)27)22-20-7-9-33(23(20)30-15-29-22)12-17-6-8-31(11-16(2)34)14-21(17)35/h4-8,10-12,14,19,22,25,36H,3,9,13,15-18H2,1-2H3;2-5,14-15,18,20-21,36H,6-13H2,1H3;4-7,9,11,17,21,23,33H,3,8,10,13-16H2,1-2H3;4-5,8,12,14,16,20,36H,3,6-7,9-11,13H2,1-2H3;4-5,7,9-10,15,17,21,35H,3,6,8,11-14H2,1-2H3
InChIKeyUVEKQYYKWFFQEF-UHFFFAOYSA-N
XLogP15.23
TPSA452.73 Ų
H-Bond Donors5
H-Bond Acceptors41
Rotatable Bonds41
Heavy Atoms176
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002435.75
LogP ≤ 515.23
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1041

Analyze 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one?
The IUPAC name of 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one (CID 167676071) is 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one.
What is the SMILES notation for 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one?
The canonical SMILES for 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one is CC(=O)CN1CCC(Cn2cnc3c(N(Cc4ccc(C(F)(F)F)cc4)C4CC4)ncnc32)C(O)C1.CCN(Cc1ccc(-n2cccn2)cc1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C#N)cc1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C(F)(F)F)cn1)c1ncnc2c1c(F)cn2CC1CCN(CC(C)=O)CC1O.CCN(Cc1ccc(C(F)(F)F)cn1)c1ncnc2c1ccn2CC1CCN(CC(C)=O)CC1O.
What is the InChIKey of 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one?
The InChIKey is UVEKQYYKWFFQEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H33N7O2.C25H29F3N6O2.C25H30N6O2.C24H28F4N6O2.C24H29F3N6O2/c1-3-32(16-21-5-7-23(8-6-21)34-12-4-11-30-34)26-24-10-14-33(27(24)29-19-28-26)17-22-9-13-31(15-20(2)35)18-25(22)36;1-16(35)10-32-9-8-18(21(36)13-32)12-33-15-31-22-23(33)29-14-30-24(22)34(20-6-7-20)11-17-2-4-19(5-3-17)25(26,27)28;1-3-30(14-20-6-4-19(12-26)5-7-20)24-22-9-11-31(25(22)28-17-27-24)15-21-8-10-29(13-18(2)32)16-23(21)33;1-3-33(11-18-5-4-17(8-29-18)24(26,27)28)22-21-19(25)12-34(23(21)31-14-30-22)10-16-6-7-32(9-15(2)35)13-20(16)36;1-3-32(13-19-5-4-18(10-28-19)24(25,26)27)22-20-7-9-33(23(20)30-15-29-22)12-17-6-8-31(11-16(2)34)14-21(17)35/h4-8,10-12,14,19,22,25,36H,3,9,13,15-18H2,1-2H3;2-5,14-15,18,20-21,36H,6-13H2,1H3;4-7,9,11,17,21,23,33H,3,8,10,13-16H2,1-2H3;4-5,8,12,14,16,20,36H,3,6-7,9-11,13H2,1-2H3;4-5,7,9-10,15,17,21,35H,3,6,8,11-14H2,1-2H3.
What are the key properties of 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one?
1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one has a molecular weight of 2435.75 g/mol, XLogP of 15.23, 41 rotatable bonds, 5 hydrogen bond donors, and 41 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[[6-[cyclopropyl-[[4-(trifluoromethyl)phenyl]methyl]amino]purin-9-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;4-[[ethyl-[7-[[3-hydroxy-1-(2-oxopropyl)piperidin-4-yl]methyl]pyrrolo[2,3-d]pyrimidin-4-yl]amino]methyl]benzonitrile;1-[4-[[4-[ethyl-[(4-pyrazol-1-ylphenyl)methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]-5-fluoropyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one;1-[4-[[4-[ethyl-[[5-(trifluoromethyl)-2-pyridinyl]methyl]amino]pyrrolo[2,3-d]pyrimidin-7-yl]methyl]-3-hydroxypiperidin-1-yl]propan-2-one is sourced from PubChem (CID 167676071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).