4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile

C187H192N60O6 — CID 164982824

IUPAC4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
SMILESCN(C)CC(C(=O)N1CCN(c2ccc(-c3nc(-c4cnn(C)c4)cn4ncc(C#N)c34)cn2)CC1)c1ccccc1.CN1C[C@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)[C@@H](c2ccccc2)C1.Cc1ccc(C(C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)cc1.Cc1cccc(C(C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1.Cc1cccc([C@@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1.Cc1cccc([C@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1
InChIInChI=1S/C32H32N10O.5C31H32N10O/c1-38-19-26(22-6-4-3-5-7-22)27(20-38)32(43)41-12-10-40(11-13-41)29-9-8-23(15-34-29)30-31-24(14-33)16-36-42(31)21-28(37-30)25-17-35-39(2)18-25;1-21-5-7-22(8-6-21)30(37(2)3)31(42)40-13-11-39(12-14-40)27-10-9-23(16-33-27)28-29-24(15-32)17-35-41(29)20-26(36-28)25-18-34-38(4)19-25;3*1-21-6-5-7-22(14-21)30(37(2)3)31(42)40-12-10-39(11-13-40)27-9-8-23(16-33-27)28-29-24(15-32)17-35-41(29)20-26(36-28)25-18-34-38(4)19-25;1-37(2)20-26(22-7-5-4-6-8-22)31(42)40-13-11-39(12-14-40)28-10-9-23(16-33-28)29-30-24(15-32)17-35-41(30)21-27(36-29)25-18-34-38(3)19-25/h3-9,15-18,21,26-27H,10-13,19-20H2,1-2H3;5-10,16-20,30H,11-14H2,1-4H3;3*5-9,14,16-20,30H,10-13H2,1-4H3;4-10,16-19,21,26H,11-14,20H2,1-3H3/t26-,27+;;2*30-;;/m1.10../s1
InChIKeyFSSNGLANDLQTGI-WJFJUXKUSA-N
MW3376.01 g/mol
LogP19.41
Rot. Bonds36

About 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile

4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile (PubChem CID 164982824) has the molecular formula C187H192N60O6 and a molecular weight of 3376.01 g/mol. Its IUPAC name is 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile.

Molecular Properties

Compound Name4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
PubChem CID164982824
Molecular FormulaC187H192N60O6
Molecular Weight3376.01 g/mol
Exact Mass3373.66
IUPAC Name4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
SMILESCN(C)CC(C(=O)N1CCN(c2ccc(-c3nc(-c4cnn(C)c4)cn4ncc(C#N)c34)cn2)CC1)c1ccccc1.CN1C[C@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)[C@@H](c2ccccc2)C1.Cc1ccc(C(C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)cc1.Cc1cccc(C(C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1.Cc1cccc([C@@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1.Cc1cccc([C@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1
InChIInChI=1S/C32H32N10O.5C31H32N10O/c1-38-19-26(22-6-4-3-5-7-22)27(20-38)32(43)41-12-10-40(11-13-41)29-9-8-23(15-34-29)30-31-24(14-33)16-36-42(31)21-28(37-30)25-17-35-39(2)18-25;1-21-5-7-22(8-6-21)30(37(2)3)31(42)40-13-11-39(12-14-40)27-10-9-23(16-33-27)28-29-24(15-32)17-35-41(29)20-26(36-28)25-18-34-38(4)19-25;3*1-21-6-5-7-22(14-21)30(37(2)3)31(42)40-12-10-39(11-13-40)27-9-8-23(16-33-27)28-29-24(15-32)17-35-41(29)20-26(36-28)25-18-34-38(4)19-25;1-37(2)20-26(22-7-5-4-6-8-22)31(42)40-13-11-39(12-14-40)28-10-9-23(16-33-28)29-30-24(15-32)17-35-41(30)21-27(36-29)25-18-34-38(3)19-25/h3-9,15-18,21,26-27H,10-13,19-20H2,1-2H3;5-10,16-20,30H,11-14H2,1-4H3;3*5-9,14,16-20,30H,10-13H2,1-4H3;4-10,16-19,21,26H,11-14,20H2,1-3H3/t26-,27+;;2*30-;;/m1.10../s1
InChIKeyFSSNGLANDLQTGI-WJFJUXKUSA-N
XLogP19.41
TPSA668.88 Ų
H-Bond Donors
H-Bond Acceptors60
Rotatable Bonds36
Heavy Atoms253
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003376.01
LogP ≤ 519.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1060

Analyze 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[6-[4-[2-(3-chlorophenyl)-2-(dimethylamino)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 135241661
4-[6-[4-[(2R)-2-hydroxy-2-phenylacetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 135241951
4-[6-[4-[(2S)-2-(3-chlorophenyl)-2-(dimethylamino)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrrol-3-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 135242167
(3S)-3-[4-[5-[3-cyano-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazin-4-yl]-2-pyridinyl]piperazine-1-carbonyl]pyrrolidine-1-carboxylic acid
CID 135241309
4-[6-[4-[2-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 146371993
4-[6-[4-[(2R)-2-amino-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 135241914
6-[(1E)-1-aminobuta-1,3-dien-2-yl]-4-[6-[4-[3-(dimethylamino)-2-(4-fluorophenyl)propanoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 170182751
4-[6-[4-[2-(3-chlorophenyl)-2-(dimethylamino)acetyl]piperazin-1-yl]-3-pyridinyl]-6-ethoxypyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134496046
4-[6-[4-[(2R)-2-(3-chlorophenyl)-2-(dimethylamino)acetyl]piperazin-1-yl]-3-pyridinyl]-6-ethoxypyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134436424
4-[6-[4-(2-hydroxy-2-phenylacetyl)piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;hydrochloride
CID 135150193
6-(1-methylpyrazol-4-yl)-4-[6-(1-oxo-1,4-thiazinan-4-yl)-3-pyridinyl]pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 175803675
4-[6-[(3R)-3-ethylpiperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile
CID 165013733

Frequently Asked Questions

What is the IUPAC name of 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile?
The IUPAC name of 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile (CID 164982824) is 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile.
What is the SMILES notation for 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile?
The canonical SMILES for 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile is CN(C)CC(C(=O)N1CCN(c2ccc(-c3nc(-c4cnn(C)c4)cn4ncc(C#N)c34)cn2)CC1)c1ccccc1.CN1C[C@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)[C@@H](c2ccccc2)C1.Cc1ccc(C(C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)cc1.Cc1cccc(C(C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1.Cc1cccc([C@@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1.Cc1cccc([C@H](C(=O)N2CCN(c3ccc(-c4nc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)N(C)C)c1.
What is the InChIKey of 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile?
The InChIKey is FSSNGLANDLQTGI-WJFJUXKUSA-N. The full InChI is InChI=1S/C32H32N10O.5C31H32N10O/c1-38-19-26(22-6-4-3-5-7-22)27(20-38)32(43)41-12-10-40(11-13-41)29-9-8-23(15-34-29)30-31-24(14-33)16-36-42(31)21-28(37-30)25-17-35-39(2)18-25;1-21-5-7-22(8-6-21)30(37(2)3)31(42)40-13-11-39(12-14-40)27-10-9-23(16-33-27)28-29-24(15-32)17-35-41(29)20-26(36-28)25-18-34-38(4)19-25;3*1-21-6-5-7-22(14-21)30(37(2)3)31(42)40-12-10-39(11-13-40)27-9-8-23(16-33-27)28-29-24(15-32)17-35-41(29)20-26(36-28)25-18-34-38(4)19-25;1-37(2)20-26(22-7-5-4-6-8-22)31(42)40-13-11-39(12-14-40)28-10-9-23(16-33-28)29-30-24(15-32)17-35-41(30)21-27(36-29)25-18-34-38(3)19-25/h3-9,15-18,21,26-27H,10-13,19-20H2,1-2H3;5-10,16-20,30H,11-14H2,1-4H3;3*5-9,14,16-20,30H,10-13H2,1-4H3;4-10,16-19,21,26H,11-14,20H2,1-3H3/t26-,27+;;2*30-;;/m1.10../s1.
What are the key properties of 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile?
4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile has a molecular weight of 3376.01 g/mol, XLogP of 19.41, 36 rotatable bonds, 0 hydrogen bond donors, and 60 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[6-[4-[(2S)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(2R)-2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(3-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[2-(dimethylamino)-2-(4-methylphenyl)acetyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[3-(dimethylamino)-2-phenylpropanoyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile;4-[6-[4-[(3R,4S)-1-methyl-4-phenylpyrrolidine-3-carbonyl]piperazin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyrazine-3-carbonitrile is sourced from PubChem (CID 164982824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).