6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

C83H68F5N21O7 — CID 164962132

IUPAC6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cc(F)ccn4)CC3)nc2)c2c(C#N)cnn2c1.CCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cc(F)nc(OC)c4)CC3)nc2)c2c(C#N)cnn2c1.CCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cncc(C(F)(F)F)c4)CC3)nc2)c2c(C#N)cnn2c1
InChIInChI=1S/C28H22F3N7O2.C28H24FN7O3.C27H22FN7O2/c1-2-40-23-12-24(27-21(13-32)16-35-38(27)18-23)20-4-5-25(34-15-20)36-7-9-37(10-8-36)26(39)6-3-19-11-22(17-33-14-19)28(29,30)31;1-3-39-22-14-23(28-21(15-30)17-32-36(28)18-22)20-5-6-25(31-16-20)34-8-10-35(11-9-34)27(37)7-4-19-12-24(29)33-26(13-19)38-2;1-2-37-23-14-24(27-20(15-29)17-32-35(27)18-23)19-3-5-25(31-16-19)33-9-11-34(12-10-33)26(36)6-4-22-13-21(28)7-8-30-22/h4-5,11-12,14-18H,2,7-10H2,1H3;5-6,12-14,16-18H,3,8-11H2,1-2H3;3,5,7-8,13-14,16-18H,2,9-12H2,1H3
InChIKeyBZFACUCZFGFGKL-UHFFFAOYSA-N
MW1566.59 g/mol
LogP9.59
Rot. Bonds13

About 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile

6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 164962132) has the molecular formula C83H68F5N21O7 and a molecular weight of 1566.59 g/mol. Its IUPAC name is 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID164962132
Molecular FormulaC83H68F5N21O7
Molecular Weight1566.59 g/mol
Exact Mass1565.55
IUPAC Name6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cc(F)ccn4)CC3)nc2)c2c(C#N)cnn2c1.CCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cc(F)nc(OC)c4)CC3)nc2)c2c(C#N)cnn2c1.CCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cncc(C(F)(F)F)c4)CC3)nc2)c2c(C#N)cnn2c1
InChIInChI=1S/C28H22F3N7O2.C28H24FN7O3.C27H22FN7O2/c1-2-40-23-12-24(27-21(13-32)16-35-38(27)18-23)20-4-5-25(34-15-20)36-7-9-37(10-8-36)26(39)6-3-19-11-22(17-33-14-19)28(29,30)31;1-3-39-22-14-23(28-21(15-30)17-32-36(28)18-22)20-5-6-25(31-16-20)34-8-10-35(11-9-34)27(37)7-4-19-12-24(29)33-26(13-19)38-2;1-2-37-23-14-24(27-20(15-29)17-32-35(27)18-23)19-3-5-25(31-16-19)33-9-11-34(12-10-33)26(36)6-4-22-13-21(28)7-8-30-22/h4-5,11-12,14-18H,2,7-10H2,1H3;5-6,12-14,16-18H,3,8-11H2,1-2H3;3,5,7-8,13-14,16-18H,2,9-12H2,1H3
InChIKeyBZFACUCZFGFGKL-UHFFFAOYSA-N
XLogP9.59
TPSA308.18 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds13
Heavy Atoms116
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001566.59
LogP ≤ 59.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-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

Selpercatinib
CID 134436906
tert-Butyl 3-(5-(3-cyano-6-(2-hydroxy-2-methylpropoxy)pyrazolo[1,5-a]pyridin-4-yl)pyridin-2-yl)-3,6-diazabicyclo[3.1.1]heptane-6-carboxylate
CID 134435575
US10023570, Example 674
CID 126740224
US10174027, Example 673
CID 126740374
US10144734, Example 206
CID 134434568
US10144734, Example 209
CID 134434689
US10144734, Example 348
CID 134434744
US10144734, Example 477
CID 134434793
US10144734, Example 45
CID 134434826
US10144734, Example 616
CID 134434860
US10144734, Example 586
CID 134434872
US10144734, Example 253
CID 134434888

Frequently Asked Questions

What is the IUPAC name of 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 164962132) is 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is CCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cc(F)ccn4)CC3)nc2)c2c(C#N)cnn2c1.CCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cc(F)nc(OC)c4)CC3)nc2)c2c(C#N)cnn2c1.CCOc1cc(-c2ccc(N3CCN(C(=O)C#Cc4cncc(C(F)(F)F)c4)CC3)nc2)c2c(C#N)cnn2c1.
What is the InChIKey of 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is BZFACUCZFGFGKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H22F3N7O2.C28H24FN7O3.C27H22FN7O2/c1-2-40-23-12-24(27-21(13-32)16-35-38(27)18-23)20-4-5-25(34-15-20)36-7-9-37(10-8-36)26(39)6-3-19-11-22(17-33-14-19)28(29,30)31;1-3-39-22-14-23(28-21(15-30)17-32-36(28)18-22)20-5-6-25(31-16-20)34-8-10-35(11-9-34)27(37)7-4-19-12-24(29)33-26(13-19)38-2;1-2-37-23-14-24(27-20(15-29)17-32-35(27)18-23)19-3-5-25(31-16-19)33-9-11-34(12-10-33)26(36)6-4-22-13-21(28)7-8-30-22/h4-5,11-12,14-18H,2,7-10H2,1H3;5-6,12-14,16-18H,3,8-11H2,1-2H3;3,5,7-8,13-14,16-18H,2,9-12H2,1H3.
What are the key properties of 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile?
6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 1566.59 g/mol, XLogP of 9.59, 13 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethoxy-4-[6-[4-[3-(2-fluoro-6-methoxy-4-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-(4-fluoro-2-pyridinyl)prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile;6-ethoxy-4-[6-[4-[3-[5-(trifluoromethyl)-3-pyridinyl]prop-2-ynoyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 164962132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).