2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine

C112H95Cl3F7N21 — CID 160809366

IUPAC2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine
SMILESCc1cccc(C(c2ccccn2)c2cnc[nH]2)c1C.Cc1cccc(C(c2cccnc2)c2cnc[nH]2)c1C.Cc1cccc(C(c2ccncc2)c2cnc[nH]2)c1C.Fc1c(C(c2ccccn2)c2cnc[nH]2)cccc1C(F)(F)F.Fc1c(Cl)cccc1C(c1ccccn1)c1cnc[nH]1.Fc1c(Cl)cccc1C(c1cccnc1)c1cnc[nH]1.Fc1c(Cl)cccc1C(c1ccncc1)c1cnc[nH]1
InChIInChI=1S/3C17H17N3.C16H11F4N3.3C15H11ClFN3/c1-12-5-3-7-15(13(12)2)17(16-10-19-11-20-16)14-6-4-8-18-9-14;1-12-6-5-7-14(13(12)2)17(16-10-18-11-20-16)15-8-3-4-9-19-15;1-12-4-3-5-15(13(12)2)17(16-10-19-11-20-16)14-6-8-18-9-7-14;17-15-10(4-3-5-11(15)16(18,19)20)14(13-8-21-9-23-13)12-6-1-2-7-22-12;16-12-5-1-4-11(15(12)17)14(13-8-19-9-20-13)10-3-2-6-18-7-10;16-11-5-3-4-10(15(11)17)14(13-8-18-9-20-13)12-6-1-2-7-19-12;16-12-3-1-2-11(15(12)17)14(13-8-19-9-20-13)10-4-6-18-7-5-10/h3-11,17H,1-2H3,(H,19,20);3-11,17H,1-2H3,(H,18,20);3-11,17H,1-2H3,(H,19,20);1-9,14H,(H,21,23);1-9,14H,(H,19,20);1-9,14H,(H,18,20);1-9,14H,(H,19,20)
InChIKeySECOXBXNSMCKDZ-UHFFFAOYSA-N
MW1974.48 g/mol
LogP26.28
Rot. Bonds21

About 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine

2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine (PubChem CID 160809366) has the molecular formula C112H95Cl3F7N21 and a molecular weight of 1974.48 g/mol. Its IUPAC name is 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine.

Molecular Properties

Compound Name2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine
PubChem CID160809366
Molecular FormulaC112H95Cl3F7N21
Molecular Weight1974.48 g/mol
Exact Mass1971.70
IUPAC Name2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine
SMILESCc1cccc(C(c2ccccn2)c2cnc[nH]2)c1C.Cc1cccc(C(c2cccnc2)c2cnc[nH]2)c1C.Cc1cccc(C(c2ccncc2)c2cnc[nH]2)c1C.Fc1c(C(c2ccccn2)c2cnc[nH]2)cccc1C(F)(F)F.Fc1c(Cl)cccc1C(c1ccccn1)c1cnc[nH]1.Fc1c(Cl)cccc1C(c1cccnc1)c1cnc[nH]1.Fc1c(Cl)cccc1C(c1ccncc1)c1cnc[nH]1
InChIInChI=1S/3C17H17N3.C16H11F4N3.3C15H11ClFN3/c1-12-5-3-7-15(13(12)2)17(16-10-19-11-20-16)14-6-4-8-18-9-14;1-12-6-5-7-14(13(12)2)17(16-10-18-11-20-16)15-8-3-4-9-19-15;1-12-4-3-5-15(13(12)2)17(16-10-19-11-20-16)14-6-8-18-9-7-14;17-15-10(4-3-5-11(15)16(18,19)20)14(13-8-21-9-23-13)12-6-1-2-7-22-12;16-12-5-1-4-11(15(12)17)14(13-8-19-9-20-13)10-3-2-6-18-7-10;16-11-5-3-4-10(15(11)17)14(13-8-18-9-20-13)12-6-1-2-7-19-12;16-12-3-1-2-11(15(12)17)14(13-8-19-9-20-13)10-4-6-18-7-5-10/h3-11,17H,1-2H3,(H,19,20);3-11,17H,1-2H3,(H,18,20);3-11,17H,1-2H3,(H,19,20);1-9,14H,(H,21,23);1-9,14H,(H,19,20);1-9,14H,(H,18,20);1-9,14H,(H,19,20)
InChIKeySECOXBXNSMCKDZ-UHFFFAOYSA-N
XLogP26.28
TPSA290.99 Ų
H-Bond Donors7
H-Bond Acceptors14
Rotatable Bonds21
Heavy Atoms143
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001974.48
LogP ≤ 526.28
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1014

Analyze 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine?
The IUPAC name of 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine (CID 160809366) is 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine.
What is the SMILES notation for 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine?
The canonical SMILES for 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine is Cc1cccc(C(c2ccccn2)c2cnc[nH]2)c1C.Cc1cccc(C(c2cccnc2)c2cnc[nH]2)c1C.Cc1cccc(C(c2ccncc2)c2cnc[nH]2)c1C.Fc1c(C(c2ccccn2)c2cnc[nH]2)cccc1C(F)(F)F.Fc1c(Cl)cccc1C(c1ccccn1)c1cnc[nH]1.Fc1c(Cl)cccc1C(c1cccnc1)c1cnc[nH]1.Fc1c(Cl)cccc1C(c1ccncc1)c1cnc[nH]1.
What is the InChIKey of 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine?
The InChIKey is SECOXBXNSMCKDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/3C17H17N3.C16H11F4N3.3C15H11ClFN3/c1-12-5-3-7-15(13(12)2)17(16-10-19-11-20-16)14-6-4-8-18-9-14;1-12-6-5-7-14(13(12)2)17(16-10-18-11-20-16)15-8-3-4-9-19-15;1-12-4-3-5-15(13(12)2)17(16-10-19-11-20-16)14-6-8-18-9-7-14;17-15-10(4-3-5-11(15)16(18,19)20)14(13-8-21-9-23-13)12-6-1-2-7-22-12;16-12-5-1-4-11(15(12)17)14(13-8-19-9-20-13)10-3-2-6-18-7-10;16-11-5-3-4-10(15(11)17)14(13-8-18-9-20-13)12-6-1-2-7-19-12;16-12-3-1-2-11(15(12)17)14(13-8-19-9-20-13)10-4-6-18-7-5-10/h3-11,17H,1-2H3,(H,19,20);3-11,17H,1-2H3,(H,18,20);3-11,17H,1-2H3,(H,19,20);1-9,14H,(H,21,23);1-9,14H,(H,19,20);1-9,14H,(H,18,20);1-9,14H,(H,19,20).
What are the key properties of 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine?
2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine has a molecular weight of 1974.48 g/mol, XLogP of 26.28, 21 rotatable bonds, 7 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(3-chloro-2-fluorophenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;3-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;4-[(2,3-dimethylphenyl)-(1H-imidazol-5-yl)methyl]pyridine;2-[[2-fluoro-3-(trifluoromethyl)phenyl]-(1H-imidazol-5-yl)methyl]pyridine is sourced from PubChem (CID 160809366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).