2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine

C173H161Cl2F13N16O7 — CID 158470081

IUPAC2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine
SMILESC.C.C.C.C.CCOc1cccc(-c2ccc(N)c(OC)n2)c1.CCOc1cccc(-c2ccc(N)c(OCC)n2)c1.CCc1cccc(-c2cccc(F)c2)n1.COc1ccc(-c2cccc(F)c2)cn1.COc1ccncc1-c1ccccc1.COc1ncccc1-c1ccccc1.Cc1ncccc1-c1cccc(F)c1.Fc1cccc(-c2ccc(F)nc2)c1.Fc1cccc(-c2cccnc2)c1.Fc1cccc(-c2cccnc2C(F)(F)F)c1.Fc1cccc(-c2cccnc2Cl)c1.Fc1cccc(-c2ccncc2)c1.Fc1cccc(-c2cnccc2Cl)c1.c1ccc(-c2cccnc2)cc1
InChIInChI=1S/C15H18N2O2.C14H16N2O2.C13H12FN.C12H7F4N.C12H10FNO.C12H10FN.2C12H11NO.2C11H7ClFN.C11H7F2N.2C11H8FN.C11H9N.5CH4/c1-3-18-12-7-5-6-11(10-12)14-9-8-13(16)15(17-14)19-4-2;1-3-18-11-6-4-5-10(9-11)13-8-7-12(15)14(16-13)17-2;1-2-12-7-4-8-13(15-12)10-5-3-6-11(14)9-10;13-9-4-1-3-8(7-9)10-5-2-6-17-11(10)12(14,15)16;1-15-12-6-5-10(8-14-12)9-3-2-4-11(13)7-9;1-9-12(6-3-7-14-9)10-4-2-5-11(13)8-10;1-14-12-11(8-5-9-13-12)10-6-3-2-4-7-10;1-14-12-7-8-13-9-11(12)10-5-3-2-4-6-10;12-11-10(5-2-6-14-11)8-3-1-4-9(13)7-8;12-11-4-5-14-7-10(11)8-2-1-3-9(13)6-8;12-10-3-1-2-8(6-10)9-4-5-11(13)14-7-9;12-11-5-1-3-9(7-11)10-4-2-6-13-8-10;12-11-3-1-2-10(8-11)9-4-6-13-7-5-9;1-2-5-10(6-3-1)11-7-4-8-12-9-11;;;;;/h5-10H,3-4,16H2,1-2H3;4-9H,3,15H2,1-2H3;3-9H,2H2,1H3;1-7H;2-8H,1H3;2-8H,1H3;2*2-9H,1H3;3*1-7H;2*1-8H;1-9H;5*1H4
InChIKeyHGGAGIITNYFMLD-UHFFFAOYSA-N
MW2894.18 g/mol
LogP46.64
Rot. Bonds25

About 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine

2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine (PubChem CID 158470081) has the molecular formula C173H161Cl2F13N16O7 and a molecular weight of 2894.18 g/mol. Its IUPAC name is 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine.

Molecular Properties

Compound Name2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine
PubChem CID158470081
Molecular FormulaC173H161Cl2F13N16O7
Molecular Weight2894.18 g/mol
Exact Mass2891.19
IUPAC Name2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine
SMILESC.C.C.C.C.CCOc1cccc(-c2ccc(N)c(OC)n2)c1.CCOc1cccc(-c2ccc(N)c(OCC)n2)c1.CCc1cccc(-c2cccc(F)c2)n1.COc1ccc(-c2cccc(F)c2)cn1.COc1ccncc1-c1ccccc1.COc1ncccc1-c1ccccc1.Cc1ncccc1-c1cccc(F)c1.Fc1cccc(-c2ccc(F)nc2)c1.Fc1cccc(-c2cccnc2)c1.Fc1cccc(-c2cccnc2C(F)(F)F)c1.Fc1cccc(-c2cccnc2Cl)c1.Fc1cccc(-c2ccncc2)c1.Fc1cccc(-c2cnccc2Cl)c1.c1ccc(-c2cccnc2)cc1
InChIInChI=1S/C15H18N2O2.C14H16N2O2.C13H12FN.C12H7F4N.C12H10FNO.C12H10FN.2C12H11NO.2C11H7ClFN.C11H7F2N.2C11H8FN.C11H9N.5CH4/c1-3-18-12-7-5-6-11(10-12)14-9-8-13(16)15(17-14)19-4-2;1-3-18-11-6-4-5-10(9-11)13-8-7-12(15)14(16-13)17-2;1-2-12-7-4-8-13(15-12)10-5-3-6-11(14)9-10;13-9-4-1-3-8(7-9)10-5-2-6-17-11(10)12(14,15)16;1-15-12-6-5-10(8-14-12)9-3-2-4-11(13)7-9;1-9-12(6-3-7-14-9)10-4-2-5-11(13)8-10;1-14-12-11(8-5-9-13-12)10-6-3-2-4-7-10;1-14-12-7-8-13-9-11(12)10-5-3-2-4-6-10;12-11-10(5-2-6-14-11)8-3-1-4-9(13)7-8;12-11-4-5-14-7-10(11)8-2-1-3-9(13)6-8;12-10-3-1-2-8(6-10)9-4-5-11(13)14-7-9;12-11-5-1-3-9(7-11)10-4-2-6-13-8-10;12-11-3-1-2-10(8-11)9-4-6-13-7-5-9;1-2-5-10(6-3-1)11-7-4-8-12-9-11;;;;;/h5-10H,3-4,16H2,1-2H3;4-9H,3,15H2,1-2H3;3-9H,2H2,1H3;1-7H;2-8H,1H3;2-8H,1H3;2*2-9H,1H3;3*1-7H;2*1-8H;1-9H;5*1H4
InChIKeyHGGAGIITNYFMLD-UHFFFAOYSA-N
XLogP46.64
TPSA297.11 Ų
H-Bond Donors2
H-Bond Acceptors23
Rotatable Bonds25
Heavy Atoms211
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002894.18
LogP ≤ 546.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

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

Analyze 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine?
The IUPAC name of 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine (CID 158470081) is 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine.
What is the SMILES notation for 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine?
The canonical SMILES for 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine is C.C.C.C.C.CCOc1cccc(-c2ccc(N)c(OC)n2)c1.CCOc1cccc(-c2ccc(N)c(OCC)n2)c1.CCc1cccc(-c2cccc(F)c2)n1.COc1ccc(-c2cccc(F)c2)cn1.COc1ccncc1-c1ccccc1.COc1ncccc1-c1ccccc1.Cc1ncccc1-c1cccc(F)c1.Fc1cccc(-c2ccc(F)nc2)c1.Fc1cccc(-c2cccnc2)c1.Fc1cccc(-c2cccnc2C(F)(F)F)c1.Fc1cccc(-c2cccnc2Cl)c1.Fc1cccc(-c2ccncc2)c1.Fc1cccc(-c2cnccc2Cl)c1.c1ccc(-c2cccnc2)cc1.
What is the InChIKey of 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine?
The InChIKey is HGGAGIITNYFMLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2.C14H16N2O2.C13H12FN.C12H7F4N.C12H10FNO.C12H10FN.2C12H11NO.2C11H7ClFN.C11H7F2N.2C11H8FN.C11H9N.5CH4/c1-3-18-12-7-5-6-11(10-12)14-9-8-13(16)15(17-14)19-4-2;1-3-18-11-6-4-5-10(9-11)13-8-7-12(15)14(16-13)17-2;1-2-12-7-4-8-13(15-12)10-5-3-6-11(14)9-10;13-9-4-1-3-8(7-9)10-5-2-6-17-11(10)12(14,15)16;1-15-12-6-5-10(8-14-12)9-3-2-4-11(13)7-9;1-9-12(6-3-7-14-9)10-4-2-5-11(13)8-10;1-14-12-11(8-5-9-13-12)10-6-3-2-4-7-10;1-14-12-7-8-13-9-11(12)10-5-3-2-4-6-10;12-11-10(5-2-6-14-11)8-3-1-4-9(13)7-8;12-11-4-5-14-7-10(11)8-2-1-3-9(13)6-8;12-10-3-1-2-8(6-10)9-4-5-11(13)14-7-9;12-11-5-1-3-9(7-11)10-4-2-6-13-8-10;12-11-3-1-2-10(8-11)9-4-6-13-7-5-9;1-2-5-10(6-3-1)11-7-4-8-12-9-11;;;;;/h5-10H,3-4,16H2,1-2H3;4-9H,3,15H2,1-2H3;3-9H,2H2,1H3;1-7H;2-8H,1H3;2-8H,1H3;2*2-9H,1H3;3*1-7H;2*1-8H;1-9H;5*1H4.
What are the key properties of 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine?
2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine has a molecular weight of 2894.18 g/mol, XLogP of 46.64, 25 rotatable bonds, 2 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-3-(3-fluorophenyl)pyridine;4-chloro-3-(3-fluorophenyl)pyridine;2-ethoxy-6-(3-ethoxyphenyl)pyridin-3-amine;6-(3-ethoxyphenyl)-2-methoxypyridin-3-amine;2-ethyl-6-(3-fluorophenyl)pyridine;2-fluoro-5-(3-fluorophenyl)pyridine;5-(3-fluorophenyl)-2-methoxypyridine;3-(3-fluorophenyl)-2-methylpyridine;3-(3-fluorophenyl)pyridine;4-(3-fluorophenyl)pyridine;3-(3-fluorophenyl)-2-(trifluoromethyl)pyridine;methane;2-methoxy-3-phenylpyridine;4-methoxy-3-phenylpyridine;3-phenylpyridine is sourced from PubChem (CID 158470081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).