N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile

C147H158N32O11 — CID 158330050

IUPACN-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile
SMILESCC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C#N)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C6CC6)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccncc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)Nc1ccc(-c2cc3c(cc2C#N)N(c2nn(C4CCOCC4)c4c2CN(C(C)=O)CC4)CCC3)cn1
InChIInChI=1S/C31H34N6O2.C30H33N7O3.C29H29N7O2.C29H32N6O2.C28H30N6O2/c1-20(38)35-12-8-29-27(19-35)31(34-37(29)25-9-13-39-14-10-25)36-11-2-3-22-15-26(24(17-32)16-30(22)36)23-6-7-28(33-18-23)21-4-5-21;1-19(38)33-29-6-5-22(17-32-29)25-14-21-4-3-10-36(28(21)15-23(25)16-31)30-26-18-35(20(2)39)11-7-27(26)37(34-30)24-8-12-40-13-9-24;1-19(37)34-10-6-27-26(18-34)29(33-36(27)24-7-11-38-12-8-24)35-9-2-3-20-13-25(22(15-30)14-28(20)35)21-4-5-23(16-31)32-17-21;1-19-5-6-22(17-31-19)25-14-21-4-3-10-34(28(21)15-23(25)16-30)29-26-18-33(20(2)36)11-7-27(26)35(32-29)24-8-12-37-13-9-24;1-19(35)32-12-6-26-25(18-32)28(31-34(26)23-7-13-36-14-8-23)33-11-2-3-21-15-24(20-4-9-30-10-5-20)22(17-29)16-27(21)33/h6-7,15-16,18,21,25H,2-5,8-14,19H2,1H3;5-6,14-15,17,24H,3-4,7-13,18H2,1-2H3,(H,32,33,38);4-5,13-14,17,24H,2-3,6-12,18H2,1H3;5-6,14-15,17,24H,3-4,7-13,18H2,1-2H3;4-5,9-10,15-16,23H,2-3,6-8,11-14,18H2,1H3
InChIKeyGPWUVNXCBCTVDF-UHFFFAOYSA-N
MW2549.09 g/mol
LogP21.80
Rot. Bonds17

About N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile

N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile (PubChem CID 158330050) has the molecular formula C147H158N32O11 and a molecular weight of 2549.09 g/mol. Its IUPAC name is N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile.

Molecular Properties

Compound NameN-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile
PubChem CID158330050
Molecular FormulaC147H158N32O11
Molecular Weight2549.09 g/mol
Exact Mass2547.28
IUPAC NameN-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile
SMILESCC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C#N)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C6CC6)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccncc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)Nc1ccc(-c2cc3c(cc2C#N)N(c2nn(C4CCOCC4)c4c2CN(C(C)=O)CC4)CCC3)cn1
InChIInChI=1S/C31H34N6O2.C30H33N7O3.C29H29N7O2.C29H32N6O2.C28H30N6O2/c1-20(38)35-12-8-29-27(19-35)31(34-37(29)25-9-13-39-14-10-25)36-11-2-3-22-15-26(24(17-32)16-30(22)36)23-6-7-28(33-18-23)21-4-5-21;1-19(38)33-29-6-5-22(17-32-29)25-14-21-4-3-10-36(28(21)15-23(25)16-31)30-26-18-35(20(2)39)11-7-27(26)37(34-30)24-8-12-40-13-9-24;1-19(37)34-10-6-27-26(18-34)29(33-36(27)24-7-11-38-12-8-24)35-9-2-3-20-13-25(22(15-30)14-28(20)35)21-4-5-23(16-31)32-17-21;1-19-5-6-22(17-31-19)25-14-21-4-3-10-34(28(21)15-23(25)16-30)29-26-18-33(20(2)36)11-7-27(26)35(32-29)24-8-12-37-13-9-24;1-19(35)32-12-6-26-25(18-32)28(31-34(26)23-7-13-36-14-8-23)33-11-2-3-21-15-24(20-4-9-30-10-5-20)22(17-29)16-27(21)33/h6-7,15-16,18,21,25H,2-5,8-14,19H2,1H3;5-6,14-15,17,24H,3-4,7-13,18H2,1-2H3,(H,32,33,38);4-5,13-14,17,24H,2-3,6-12,18H2,1H3;5-6,14-15,17,24H,3-4,7-13,18H2,1-2H3;4-5,9-10,15-16,23H,2-3,6-8,11-14,18H2,1H3
InChIKeyGPWUVNXCBCTVDF-UHFFFAOYSA-N
XLogP21.80
TPSA489.29 Ų
H-Bond Donors1
H-Bond Acceptors37
Rotatable Bonds17
Heavy Atoms190
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002549.09
LogP ≤ 521.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'dyes5A(27)', 'substructure': 'N/A'}

Analyze N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile?
The IUPAC name of N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile (CID 158330050) is N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile.
What is the SMILES notation for N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile?
The canonical SMILES for N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile is CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C#N)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccc(C6CC6)nc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)N1CCc2c(c(N3CCCc4cc(-c5ccncc5)c(C#N)cc43)nn2C2CCOCC2)C1.CC(=O)Nc1ccc(-c2cc3c(cc2C#N)N(c2nn(C4CCOCC4)c4c2CN(C(C)=O)CC4)CCC3)cn1.
What is the InChIKey of N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile?
The InChIKey is GPWUVNXCBCTVDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H34N6O2.C30H33N7O3.C29H29N7O2.C29H32N6O2.C28H30N6O2/c1-20(38)35-12-8-29-27(19-35)31(34-37(29)25-9-13-39-14-10-25)36-11-2-3-22-15-26(24(17-32)16-30(22)36)23-6-7-28(33-18-23)21-4-5-21;1-19(38)33-29-6-5-22(17-32-29)25-14-21-4-3-10-36(28(21)15-23(25)16-31)30-26-18-35(20(2)39)11-7-27(26)37(34-30)24-8-12-40-13-9-24;1-19(37)34-10-6-27-26(18-34)29(33-36(27)24-7-11-38-12-8-24)35-9-2-3-20-13-25(22(15-30)14-28(20)35)21-4-5-23(16-31)32-17-21;1-19-5-6-22(17-31-19)25-14-21-4-3-10-34(28(21)15-23(25)16-30)29-26-18-33(20(2)36)11-7-27(26)35(32-29)24-8-12-37-13-9-24;1-19(35)32-12-6-26-25(18-32)28(31-34(26)23-7-13-36-14-8-23)33-11-2-3-21-15-24(20-4-9-30-10-5-20)22(17-29)16-27(21)33/h6-7,15-16,18,21,25H,2-5,8-14,19H2,1H3;5-6,14-15,17,24H,3-4,7-13,18H2,1-2H3,(H,32,33,38);4-5,13-14,17,24H,2-3,6-12,18H2,1H3;5-6,14-15,17,24H,3-4,7-13,18H2,1-2H3;4-5,9-10,15-16,23H,2-3,6-8,11-14,18H2,1H3.
What are the key properties of N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile?
N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile has a molecular weight of 2549.09 g/mol, XLogP of 21.80, 17 rotatable bonds, 1 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-7-cyano-3,4-dihydro-2H-quinolin-6-yl]-2-pyridinyl]acetamide;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyano-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-cyclopropyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-(6-methyl-3-pyridinyl)-3,4-dihydro-2H-quinoline-7-carbonitrile;1-[5-acetyl-1-(oxan-4-yl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-3-yl]-6-pyridin-4-yl-3,4-dihydro-2H-quinoline-7-carbonitrile is sourced from PubChem (CID 158330050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).