bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)

C142H176Cl2F6N20O3S2 — CID 160854101

IUPACbis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)
SMILESCCOc1ccccn1.CCOc1cccnc1.CCOc1ccncc1.CCSc1ccccn1.CCSc1ccncc1.CCc1cc(C)ccn1.CCc1ccc(C)cn1.CCc1cccc(C)n1.CCc1cccc(C)n1.CCc1ncccc1C.Cc1ccc(C(F)(F)F)cn1.Cc1ccc(C(F)(F)F)cn1.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1ccc(Cl)cn1.Cc1ccc(Cl)cn1.Cc1cccc(C)n1.Cc1ccccn1.Cc1cccnc1C.Cc1ccnc(C)c1
InChIInChI=1S/5C8H11N.2C7H6F3N.3C7H9NO.2C7H9NS.5C7H9N.2C6H6ClN.C6H7N/c1-3-8-6-7(2)4-5-9-8;1-3-8-5-4-7(2)6-9-8;1-3-8-7(2)5-4-6-9-8;2*1-3-8-6-4-5-7(2)9-8;2*1-5-2-3-6(4-11-5)7(8,9)10;1-2-9-7-3-5-8-6-4-7;1-2-9-7-4-3-5-8-6-7;1-2-9-7-5-3-4-6-8-7;1-2-9-7-3-5-8-6-4-7;1-2-9-7-5-3-4-6-8-7;1-6-3-4-8-7(2)5-6;2*1-6-3-4-7(2)8-5-6;1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;2*1-5-2-3-6(7)4-8-5;1-6-4-2-3-5-7-6/h5*4-6H,3H2,1-2H3;2*2-4H,1H3;5*3-6H,2H2,1H3;5*3-5H,1-2H3;2*2-4H,1H3;2-5H,1H3
InChIKeySJQJAAXGPZSDDL-UHFFFAOYSA-N
MW2460.13 g/mol
LogP37.38
Rot. Bonds15

About bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)

bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine) (PubChem CID 160854101) has the molecular formula C142H176Cl2F6N20O3S2 and a molecular weight of 2460.13 g/mol. Its IUPAC name is bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine).

Molecular Properties

Compound Namebis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)
PubChem CID160854101
Molecular FormulaC142H176Cl2F6N20O3S2
Molecular Weight2460.13 g/mol
Exact Mass2457.30
IUPAC Namebis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)
SMILESCCOc1ccccn1.CCOc1cccnc1.CCOc1ccncc1.CCSc1ccccn1.CCSc1ccncc1.CCc1cc(C)ccn1.CCc1ccc(C)cn1.CCc1cccc(C)n1.CCc1cccc(C)n1.CCc1ncccc1C.Cc1ccc(C(F)(F)F)cn1.Cc1ccc(C(F)(F)F)cn1.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1ccc(Cl)cn1.Cc1ccc(Cl)cn1.Cc1cccc(C)n1.Cc1ccccn1.Cc1cccnc1C.Cc1ccnc(C)c1
InChIInChI=1S/5C8H11N.2C7H6F3N.3C7H9NO.2C7H9NS.5C7H9N.2C6H6ClN.C6H7N/c1-3-8-6-7(2)4-5-9-8;1-3-8-5-4-7(2)6-9-8;1-3-8-7(2)5-4-6-9-8;2*1-3-8-6-4-5-7(2)9-8;2*1-5-2-3-6(4-11-5)7(8,9)10;1-2-9-7-3-5-8-6-4-7;1-2-9-7-4-3-5-8-6-7;1-2-9-7-5-3-4-6-8-7;1-2-9-7-3-5-8-6-4-7;1-2-9-7-5-3-4-6-8-7;1-6-3-4-8-7(2)5-6;2*1-6-3-4-7(2)8-5-6;1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;2*1-5-2-3-6(7)4-8-5;1-6-4-2-3-5-7-6/h5*4-6H,3H2,1-2H3;2*2-4H,1H3;5*3-6H,2H2,1H3;5*3-5H,1-2H3;2*2-4H,1H3;2-5H,1H3
InChIKeySJQJAAXGPZSDDL-UHFFFAOYSA-N
XLogP37.38
TPSA285.49 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds15
Heavy Atoms175
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002460.13
LogP ≤ 537.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Analyze bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine) 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

Frequently Asked Questions

What is the IUPAC name of bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)?
The IUPAC name of bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine) (CID 160854101) is bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine).
What is the SMILES notation for bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)?
The canonical SMILES for bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine) is CCOc1ccccn1.CCOc1cccnc1.CCOc1ccncc1.CCSc1ccccn1.CCSc1ccncc1.CCc1cc(C)ccn1.CCc1ccc(C)cn1.CCc1cccc(C)n1.CCc1cccc(C)n1.CCc1ncccc1C.Cc1ccc(C(F)(F)F)cn1.Cc1ccc(C(F)(F)F)cn1.Cc1ccc(C)nc1.Cc1ccc(C)nc1.Cc1ccc(Cl)cn1.Cc1ccc(Cl)cn1.Cc1cccc(C)n1.Cc1ccccn1.Cc1cccnc1C.Cc1ccnc(C)c1.
What is the InChIKey of bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)?
The InChIKey is SJQJAAXGPZSDDL-UHFFFAOYSA-N. The full InChI is InChI=1S/5C8H11N.2C7H6F3N.3C7H9NO.2C7H9NS.5C7H9N.2C6H6ClN.C6H7N/c1-3-8-6-7(2)4-5-9-8;1-3-8-5-4-7(2)6-9-8;1-3-8-7(2)5-4-6-9-8;2*1-3-8-6-4-5-7(2)9-8;2*1-5-2-3-6(4-11-5)7(8,9)10;1-2-9-7-3-5-8-6-4-7;1-2-9-7-4-3-5-8-6-7;1-2-9-7-5-3-4-6-8-7;1-2-9-7-3-5-8-6-4-7;1-2-9-7-5-3-4-6-8-7;1-6-3-4-8-7(2)5-6;2*1-6-3-4-7(2)8-5-6;1-6-4-3-5-8-7(6)2;1-6-4-3-5-7(2)8-6;2*1-5-2-3-6(7)4-8-5;1-6-4-2-3-5-7-6/h5*4-6H,3H2,1-2H3;2*2-4H,1H3;5*3-6H,2H2,1H3;5*3-5H,1-2H3;2*2-4H,1H3;2-5H,1H3.
What are the key properties of bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine)?
bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine) has a molecular weight of 2460.13 g/mol, XLogP of 37.38, 15 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for bis(5-chloro-2-methylpyridine);2,3-dimethylpyridine;2,4-dimethylpyridine;bis(2,5-dimethylpyridine);2,6-dimethylpyridine;2-ethoxypyridine;3-ethoxypyridine;4-ethoxypyridine;2-ethyl-3-methylpyridine;2-ethyl-4-methylpyridine;2-ethyl-5-methylpyridine;bis(2-ethyl-6-methylpyridine);2-ethylsulfanylpyridine;4-ethylsulfanylpyridine;2-methylpyridine;bis(2-methyl-5-(trifluoromethyl)pyridine) is sourced from PubChem (CID 160854101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).