3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)

C162H167Cl2F3N34 — CID 161222129

IUPAC3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)
SMILESCc1cc(C)c2ncccc2c1.Cc1cc(C)nc(C(F)(F)F)c1.Cc1cc(C)nc(C)c1.Cc1cc(C)nc(C)c1.Cc1cc(C)nc(C)c1.Cc1cc(Cl)c2[nH]ncc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CCCN2.Cc1ccc2cnccc2c1.Cc1ccc2n[nH]c(Cl)c2c1.Cc1ccc2nc(N)ncc2c1.Cc1ccc2ncccc2c1.Cc1ccc2nccn2c1.Cc1ccc2nccnc2c1.Cc1ccc2ncncc2c1.Cc1ccc2ncnn2c1.Cc1ccc2nnccc2c1.Cc1ccc2nncn2c1.Cc1ccn2ncnc2c1
InChIInChI=1S/C11H11N.C10H9N.C10H13N.C10H9N.C9H9N3.3C9H8N2.2C8H7ClN2.C8H8F3N.2C8H8N2.3C8H11N.3C7H7N3/c1-8-6-9(2)11-10(7-8)4-3-5-12-11;1-8-2-3-10-7-11-5-4-9(10)6-8;2*1-8-4-5-10-9(7-8)3-2-6-11-10;1-6-2-3-8-7(4-6)5-11-9(10)12-8;1-7-2-3-9-8(4-7)5-10-6-11-9;1-7-2-3-9-8(6-7)4-5-10-11-9;1-7-2-3-8-9(6-7)11-5-4-10-8;1-5-2-6-4-10-11-8(6)7(9)3-5;1-5-2-3-7-6(4-5)8(9)11-10-7;1-5-3-6(2)12-7(4-5)8(9,10)11;1-6-2-3-8-7(4-6)5-9-10-8;1-7-2-3-8-9-4-5-10(8)6-7;3*1-6-4-7(2)9-8(3)5-6;1-6-2-3-10-7(4-6)8-5-9-10;1-6-2-3-7-9-8-5-10(7)4-6;1-6-2-3-7-8-5-9-10(7)4-6/h3-7H,1-2H3;2-7H,1H3;4-5,7,11H,2-3,6H2,1H3;2-7H,1H3;2-5H,1H3,(H2,10,11,12);3*2-6H,1H3;2*2-4H,1H3,(H,10,11);3-4H,1-2H3;2-5H,1H3,(H,9,10);2-6H,1H3;3*4-5H,1-3H3;3*2-5H,1H3
InChIKeyUXQPLGIVJCDPQR-UHFFFAOYSA-N
MW2718.26 g/mol
LogP38.04
Rot. Bonds

About 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)

3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine) (PubChem CID 161222129) has the molecular formula C162H167Cl2F3N34 and a molecular weight of 2718.26 g/mol. Its IUPAC name is 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine).

Molecular Properties

Compound Name3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)
PubChem CID161222129
Molecular FormulaC162H167Cl2F3N34
Molecular Weight2718.26 g/mol
Exact Mass2715.34
IUPAC Name3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)
SMILESCc1cc(C)c2ncccc2c1.Cc1cc(C)nc(C(F)(F)F)c1.Cc1cc(C)nc(C)c1.Cc1cc(C)nc(C)c1.Cc1cc(C)nc(C)c1.Cc1cc(Cl)c2[nH]ncc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CCCN2.Cc1ccc2cnccc2c1.Cc1ccc2n[nH]c(Cl)c2c1.Cc1ccc2nc(N)ncc2c1.Cc1ccc2ncccc2c1.Cc1ccc2nccn2c1.Cc1ccc2nccnc2c1.Cc1ccc2ncncc2c1.Cc1ccc2ncnn2c1.Cc1ccc2nnccc2c1.Cc1ccc2nncn2c1.Cc1ccn2ncnc2c1
InChIInChI=1S/C11H11N.C10H9N.C10H13N.C10H9N.C9H9N3.3C9H8N2.2C8H7ClN2.C8H8F3N.2C8H8N2.3C8H11N.3C7H7N3/c1-8-6-9(2)11-10(7-8)4-3-5-12-11;1-8-2-3-10-7-11-5-4-9(10)6-8;2*1-8-4-5-10-9(7-8)3-2-6-11-10;1-6-2-3-8-7(4-6)5-11-9(10)12-8;1-7-2-3-9-8(4-7)5-10-6-11-9;1-7-2-3-9-8(6-7)4-5-10-11-9;1-7-2-3-8-9(6-7)11-5-4-10-8;1-5-2-6-4-10-11-8(6)7(9)3-5;1-5-2-3-7-6(4-5)8(9)11-10-7;1-5-3-6(2)12-7(4-5)8(9,10)11;1-6-2-3-8-7(4-6)5-9-10-8;1-7-2-3-8-9-4-5-10(8)6-7;3*1-6-4-7(2)9-8(3)5-6;1-6-2-3-10-7(4-6)8-5-9-10;1-6-2-3-7-9-8-5-10(7)4-6;1-6-2-3-7-8-5-9-10(7)4-6/h3-7H,1-2H3;2-7H,1H3;4-5,7,11H,2-3,6H2,1H3;2-7H,1H3;2-5H,1H3,(H2,10,11,12);3*2-6H,1H3;2*2-4H,1H3,(H,10,11);3-4H,1-2H3;2-5H,1H3,(H,9,10);2-6H,1H3;3*4-5H,1-3H3;3*2-5H,1H3
InChIKeyUXQPLGIVJCDPQR-UHFFFAOYSA-N
XLogP38.04
TPSA425.31 Ų
H-Bond Donors5
H-Bond Acceptors31
Rotatable Bonds
Heavy Atoms201
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002718.26
LogP ≤ 538.04
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1031

Analyze 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine) with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)?
The IUPAC name of 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine) (CID 161222129) is 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine).
What is the SMILES notation for 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)?
The canonical SMILES for 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine) is Cc1cc(C)c2ncccc2c1.Cc1cc(C)nc(C(F)(F)F)c1.Cc1cc(C)nc(C)c1.Cc1cc(C)nc(C)c1.Cc1cc(C)nc(C)c1.Cc1cc(Cl)c2[nH]ncc2c1.Cc1ccc2[nH]ncc2c1.Cc1ccc2c(c1)CCCN2.Cc1ccc2cnccc2c1.Cc1ccc2n[nH]c(Cl)c2c1.Cc1ccc2nc(N)ncc2c1.Cc1ccc2ncccc2c1.Cc1ccc2nccn2c1.Cc1ccc2nccnc2c1.Cc1ccc2ncncc2c1.Cc1ccc2ncnn2c1.Cc1ccc2nnccc2c1.Cc1ccc2nncn2c1.Cc1ccn2ncnc2c1.
What is the InChIKey of 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)?
The InChIKey is UXQPLGIVJCDPQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N.C10H9N.C10H13N.C10H9N.C9H9N3.3C9H8N2.2C8H7ClN2.C8H8F3N.2C8H8N2.3C8H11N.3C7H7N3/c1-8-6-9(2)11-10(7-8)4-3-5-12-11;1-8-2-3-10-7-11-5-4-9(10)6-8;2*1-8-4-5-10-9(7-8)3-2-6-11-10;1-6-2-3-8-7(4-6)5-11-9(10)12-8;1-7-2-3-9-8(4-7)5-10-6-11-9;1-7-2-3-9-8(6-7)4-5-10-11-9;1-7-2-3-8-9(6-7)11-5-4-10-8;1-5-2-6-4-10-11-8(6)7(9)3-5;1-5-2-3-7-6(4-5)8(9)11-10-7;1-5-3-6(2)12-7(4-5)8(9,10)11;1-6-2-3-8-7(4-6)5-9-10-8;1-7-2-3-8-9-4-5-10(8)6-7;3*1-6-4-7(2)9-8(3)5-6;1-6-2-3-10-7(4-6)8-5-9-10;1-6-2-3-7-9-8-5-10(7)4-6;1-6-2-3-7-8-5-9-10(7)4-6/h3-7H,1-2H3;2-7H,1H3;4-5,7,11H,2-3,6H2,1H3;2-7H,1H3;2-5H,1H3,(H2,10,11,12);3*2-6H,1H3;2*2-4H,1H3,(H,10,11);3-4H,1-2H3;2-5H,1H3,(H,9,10);2-6H,1H3;3*4-5H,1-3H3;3*2-5H,1H3.
What are the key properties of 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine)?
3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine) has a molecular weight of 2718.26 g/mol, XLogP of 38.04, 0 rotatable bonds, 5 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-methyl-2H-indazole;7-chloro-5-methyl-1H-indazole;6,8-dimethylquinoline;2,4-dimethyl-6-(trifluoromethyl)pyridine;6-methylcinnoline;6-methylimidazo[1,2-a]pyridine;5-methyl-1H-indazole;6-methylisoquinoline;6-methylquinazolin-2-amine;6-methylquinazoline;6-methylquinoline;6-methylquinoxaline;6-methyl-1,2,3,4-tetrahydroquinoline;6-methyl-[1,2,4]triazolo[1,5-a]pyridine;6-methyl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-[1,2,4]triazolo[1,5-a]pyridine;tris(2,4,6-trimethylpyridine) is sourced from PubChem (CID 161222129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).