N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine

C116H103Cl2FN30 — CID 158012117

IUPACN-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine
SMILESCCc1nn2ccccc2c1-c1cncc(Nc2ccc(C)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccc(Cl)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccc(F)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccccc2)n1.Cc1ccc(Nc2cc(N)cc(-n3c(C)nc4ccccc43)n2)cc1.Cc1nc2ccccc2n1-c1cc(N)cc(Nc2ccc(Cl)cc2)n1
InChIInChI=1S/2C20H19N5.2C19H16ClN5.C19H16FN5.C19H17N5/c1-13-7-9-16(10-8-13)23-19-11-15(21)12-20(24-19)25-14(2)22-17-5-3-4-6-18(17)25;1-3-16-20(18-6-4-5-11-25(18)24-16)17-12-21-13-19(23-17)22-15-9-7-14(2)8-10-15;1-12-22-16-4-2-3-5-17(16)25(12)19-11-14(21)10-18(24-19)23-15-8-6-13(20)7-9-15;2*1-2-15-19(17-5-3-4-10-25(17)24-15)16-11-21-12-18(23-16)22-14-8-6-13(20)7-9-14;1-2-15-19(17-10-6-7-11-24(17)23-15)16-12-20-13-18(22-16)21-14-8-4-3-5-9-14/h3-12H,1-2H3,(H3,21,23,24);4-13H,3H2,1-2H3,(H,22,23);2-11H,1H3,(H3,21,23,24);2*3-12H,2H2,1H3,(H,22,23);3-13H,2H2,1H3,(H,21,22)
InChIKeyFFABOVDWDJBFBS-UHFFFAOYSA-N
MW2007.21 g/mol
LogP26.56
Rot. Bonds22

About N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine

N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine (PubChem CID 158012117) has the molecular formula C116H103Cl2FN30 and a molecular weight of 2007.21 g/mol. Its IUPAC name is N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine.

Molecular Properties

Compound NameN-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine
PubChem CID158012117
Molecular FormulaC116H103Cl2FN30
Molecular Weight2007.21 g/mol
Exact Mass2004.83
IUPAC NameN-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine
SMILESCCc1nn2ccccc2c1-c1cncc(Nc2ccc(C)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccc(Cl)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccc(F)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccccc2)n1.Cc1ccc(Nc2cc(N)cc(-n3c(C)nc4ccccc43)n2)cc1.Cc1nc2ccccc2n1-c1cc(N)cc(Nc2ccc(Cl)cc2)n1
InChIInChI=1S/2C20H19N5.2C19H16ClN5.C19H16FN5.C19H17N5/c1-13-7-9-16(10-8-13)23-19-11-15(21)12-20(24-19)25-14(2)22-17-5-3-4-6-18(17)25;1-3-16-20(18-6-4-5-11-25(18)24-16)17-12-21-13-19(23-17)22-15-9-7-14(2)8-10-15;1-12-22-16-4-2-3-5-17(16)25(12)19-11-14(21)10-18(24-19)23-15-8-6-13(20)7-9-15;2*1-2-15-19(17-5-3-4-10-25(17)24-15)16-11-21-12-18(23-16)22-14-8-6-13(20)7-9-14;1-2-15-19(17-10-6-7-11-24(17)23-15)16-12-20-13-18(22-16)21-14-8-4-3-5-9-14/h3-12H,1-2H3,(H3,21,23,24);4-13H,3H2,1-2H3,(H,22,23);2-11H,1H3,(H3,21,23,24);2*3-12H,2H2,1H3,(H,22,23);3-13H,2H2,1H3,(H,21,22)
InChIKeyFFABOVDWDJBFBS-UHFFFAOYSA-N
XLogP26.56
TPSA357.96 Ų
H-Bond Donors8
H-Bond Acceptors30
Rotatable Bonds22
Heavy Atoms149
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002007.21
LogP ≤ 526.56
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1030

Analyze N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine?
The IUPAC name of N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine (CID 158012117) is N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine.
What is the SMILES notation for N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine?
The canonical SMILES for N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine is CCc1nn2ccccc2c1-c1cncc(Nc2ccc(C)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccc(Cl)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccc(F)cc2)n1.CCc1nn2ccccc2c1-c1cncc(Nc2ccccc2)n1.Cc1ccc(Nc2cc(N)cc(-n3c(C)nc4ccccc43)n2)cc1.Cc1nc2ccccc2n1-c1cc(N)cc(Nc2ccc(Cl)cc2)n1.
What is the InChIKey of N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine?
The InChIKey is FFABOVDWDJBFBS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H19N5.2C19H16ClN5.C19H16FN5.C19H17N5/c1-13-7-9-16(10-8-13)23-19-11-15(21)12-20(24-19)25-14(2)22-17-5-3-4-6-18(17)25;1-3-16-20(18-6-4-5-11-25(18)24-16)17-12-21-13-19(23-17)22-15-9-7-14(2)8-10-15;1-12-22-16-4-2-3-5-17(16)25(12)19-11-14(21)10-18(24-19)23-15-8-6-13(20)7-9-15;2*1-2-15-19(17-5-3-4-10-25(17)24-15)16-11-21-12-18(23-16)22-14-8-6-13(20)7-9-14;1-2-15-19(17-10-6-7-11-24(17)23-15)16-12-20-13-18(22-16)21-14-8-4-3-5-9-14/h3-12H,1-2H3,(H3,21,23,24);4-13H,3H2,1-2H3,(H,22,23);2-11H,1H3,(H3,21,23,24);2*3-12H,2H2,1H3,(H,22,23);3-13H,2H2,1H3,(H,21,22).
What are the key properties of N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine?
N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine has a molecular weight of 2007.21 g/mol, XLogP of 26.56, 22 rotatable bonds, 8 hydrogen bond donors, and 30 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)pyrazin-2-amine;2-N-(4-chlorophenyl)-6-(2-methylbenzimidazol-1-yl)pyridine-2,4-diamine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-fluorophenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-(4-methylphenyl)pyrazin-2-amine;6-(2-ethylpyrazolo[1,5-a]pyridin-3-yl)-N-phenylpyrazin-2-amine;6-(2-methylbenzimidazol-1-yl)-2-N-(4-methylphenyl)pyridine-2,4-diamine is sourced from PubChem (CID 158012117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).