6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine

C116H101ClF8N24 — CID 161451766

IUPAC6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESC.C.C.C.C.C.Cc1cc(-c2ncccc2-c2cnc3nccn3c2)ccc1F.Cc1cc2nccn2cc1-c1cccnc1-c1ccc(F)c(Cl)c1.Cc1cccc(-c2ncccc2-c2cnc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3ncnn3c2)c1.c1cc(-c2ncccc2-c2cnc3nccn3c2)cc(C2CC2)c1
InChIInChI=1S/C20H16N4.C19H13ClFN3.C18H11F3N4.C18H13FN4.C18H14N4.C17H10F3N5.6CH4/c1-3-15(14-6-7-14)11-16(4-1)19-18(5-2-8-21-19)17-12-23-20-22-9-10-24(20)13-17;1-12-9-18-22-7-8-24(18)11-15(12)14-3-2-6-23-19(14)13-4-5-17(21)16(20)10-13;19-18(20,21)14-4-1-3-12(9-14)16-15(5-2-6-22-16)13-10-24-17-23-7-8-25(17)11-13;1-12-9-13(4-5-16(12)19)17-15(3-2-6-20-17)14-10-22-18-21-7-8-23(18)11-14;1-13-4-2-5-14(10-13)17-16(6-3-7-19-17)15-11-21-18-20-8-9-22(18)12-15;18-17(19,20)13-4-1-3-11(7-13)15-14(5-2-6-21-15)12-8-22-16-23-10-24-25(16)9-12;;;;;;/h1-5,8-14H,6-7H2;2-11H,1H3;1-11H;2-11H,1H3;2-12H,1H3;1-10H;6*1H4
InChIKeyWAPSRXSQJKLQBR-UHFFFAOYSA-N
MW2018.69 g/mol
LogP29.34
Rot. Bonds13

About 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine

6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 161451766) has the molecular formula C116H101ClF8N24 and a molecular weight of 2018.69 g/mol. Its IUPAC name is 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID161451766
Molecular FormulaC116H101ClF8N24
Molecular Weight2018.69 g/mol
Exact Mass2016.82
IUPAC Name6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESC.C.C.C.C.C.Cc1cc(-c2ncccc2-c2cnc3nccn3c2)ccc1F.Cc1cc2nccn2cc1-c1cccnc1-c1ccc(F)c(Cl)c1.Cc1cccc(-c2ncccc2-c2cnc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3ncnn3c2)c1.c1cc(-c2ncccc2-c2cnc3nccn3c2)cc(C2CC2)c1
InChIInChI=1S/C20H16N4.C19H13ClFN3.C18H11F3N4.C18H13FN4.C18H14N4.C17H10F3N5.6CH4/c1-3-15(14-6-7-14)11-16(4-1)19-18(5-2-8-21-19)17-12-23-20-22-9-10-24(20)13-17;1-12-9-18-22-7-8-24(18)11-15(12)14-3-2-6-23-19(14)13-4-5-17(21)16(20)10-13;19-18(20,21)14-4-1-3-12(9-14)16-15(5-2-6-22-16)13-10-24-17-23-7-8-25(17)11-13;1-12-9-13(4-5-16(12)19)17-15(3-2-6-20-17)14-10-22-18-21-7-8-23(18)11-14;1-13-4-2-5-14(10-13)17-16(6-3-7-19-17)15-11-21-18-20-8-9-22(18)12-15;18-17(19,20)13-4-1-3-11(7-13)15-14(5-2-6-21-15)12-8-22-16-23-10-24-25(16)9-12;;;;;;/h1-5,8-14H,6-7H2;2-11H,1H3;1-11H;2-11H,1H3;2-12H,1H3;1-10H;6*1H4
InChIKeyWAPSRXSQJKLQBR-UHFFFAOYSA-N
XLogP29.34
TPSA258.48 Ų
H-Bond Donors
H-Bond Acceptors24
Rotatable Bonds13
Heavy Atoms149
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002018.69
LogP ≤ 529.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1024

Analyze 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine (CID 161451766) is 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine is C.C.C.C.C.C.Cc1cc(-c2ncccc2-c2cnc3nccn3c2)ccc1F.Cc1cc2nccn2cc1-c1cccnc1-c1ccc(F)c(Cl)c1.Cc1cccc(-c2ncccc2-c2cnc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3nccn3c2)c1.FC(F)(F)c1cccc(-c2ncccc2-c2cnc3ncnn3c2)c1.c1cc(-c2ncccc2-c2cnc3nccn3c2)cc(C2CC2)c1.
What is the InChIKey of 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is WAPSRXSQJKLQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4.C19H13ClFN3.C18H11F3N4.C18H13FN4.C18H14N4.C17H10F3N5.6CH4/c1-3-15(14-6-7-14)11-16(4-1)19-18(5-2-8-21-19)17-12-23-20-22-9-10-24(20)13-17;1-12-9-18-22-7-8-24(18)11-15(12)14-3-2-6-23-19(14)13-4-5-17(21)16(20)10-13;19-18(20,21)14-4-1-3-12(9-14)16-15(5-2-6-22-16)13-10-24-17-23-7-8-25(17)11-13;1-12-9-13(4-5-16(12)19)17-15(3-2-6-20-17)14-10-22-18-21-7-8-23(18)11-14;1-13-4-2-5-14(10-13)17-16(6-3-7-19-17)15-11-21-18-20-8-9-22(18)12-15;18-17(19,20)13-4-1-3-11(7-13)15-14(5-2-6-21-15)12-8-22-16-23-10-24-25(16)9-12;;;;;;/h1-5,8-14H,6-7H2;2-11H,1H3;1-11H;2-11H,1H3;2-12H,1H3;1-10H;6*1H4.
What are the key properties of 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine?
6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 2018.69 g/mol, XLogP of 29.34, 13 rotatable bonds, 0 hydrogen bond donors, and 24 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(3-chloro-4-fluorophenyl)-3-pyridinyl]-7-methylimidazo[1,2-a]pyridine;6-[2-(3-cyclopropylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;methane;6-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyrimidine;6-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 161451766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).