2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole

C155H160Cl2F5N49O2 — CID 160639298

IUPAC2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole
SMILESCOc1ccc(-n2nccn2)c(C)c1.COc1ccc(-n2nccn2)c(C)c1F.Cc1cc(C)c(-n2nccn2)cc1C.Cc1cc(Cl)ccc1-n1nccn1.Cc1cc(F)ccc1-n1nccn1.Cc1ccc(-n2nccn2)c(C)c1.Cc1ccc(-n2nccn2)c(C)c1F.Cc1ccc(-n2nccn2)c(C)n1.Cc1ccc(C)c(-n2nccn2)c1.Cc1ccc(C)c(-n2nccn2)c1.Cc1ccc(C)c(-n2nccn2)c1C.Cc1ccc(Cl)cc1-n1nccn1.Cc1ccc(F)cc1-n1nccn1.Cc1cccc(C)c1-n1nccn1.Cc1cccc(F)c1-n1nccn1.Cc1ccccc1-n1nccn1
InChIInChI=1S/2C11H13N3.C10H10FN3O.C10H10FN3.C10H11N3O.4C10H11N3.2C9H8ClN3.3C9H8FN3.C9H10N4.C9H9N3/c1-8-6-10(3)11(7-9(8)2)14-12-4-5-13-14;1-8-4-5-9(2)11(10(8)3)14-12-6-7-13-14;1-7-8(14-12-5-6-13-14)3-4-9(15-2)10(7)11;1-7-3-4-9(8(2)10(7)11)14-12-5-6-13-14;1-8-7-9(14-2)3-4-10(8)13-11-5-6-12-13;1-8-3-4-10(9(2)7-8)13-11-5-6-12-13;2*1-8-3-4-9(2)10(7-8)13-11-5-6-12-13;1-8-4-3-5-9(2)10(8)13-11-6-7-12-13;1-7-6-8(10)2-3-9(7)13-11-4-5-12-13;1-7-2-3-8(10)6-9(7)13-11-4-5-12-13;1-7-6-8(10)2-3-9(7)13-11-4-5-12-13;1-7-2-3-8(10)6-9(7)13-11-4-5-12-13;1-7-3-2-4-8(10)9(7)13-11-5-6-12-13;1-7-3-4-9(8(2)12-7)13-10-5-6-11-13;1-8-4-2-3-5-9(8)12-10-6-7-11-12/h2*4-7H,1-3H3;3-6H,1-2H3;3-6H,1-2H3;3-7H,1-2H3;4*3-7H,1-2H3;5*2-6H,1H3;3-6H,1-2H3;2-7H,1H3
InChIKeyRIYOPZBRNFZJLC-UHFFFAOYSA-N
MW2907.22 g/mol
LogP29.71
Rot. Bonds18

About 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole

2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole (PubChem CID 160639298) has the molecular formula C155H160Cl2F5N49O2 and a molecular weight of 2907.22 g/mol. Its IUPAC name is 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole.

Molecular Properties

Compound Name2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole
PubChem CID160639298
Molecular FormulaC155H160Cl2F5N49O2
Molecular Weight2907.22 g/mol
Exact Mass2904.32
IUPAC Name2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole
SMILESCOc1ccc(-n2nccn2)c(C)c1.COc1ccc(-n2nccn2)c(C)c1F.Cc1cc(C)c(-n2nccn2)cc1C.Cc1cc(Cl)ccc1-n1nccn1.Cc1cc(F)ccc1-n1nccn1.Cc1ccc(-n2nccn2)c(C)c1.Cc1ccc(-n2nccn2)c(C)c1F.Cc1ccc(-n2nccn2)c(C)n1.Cc1ccc(C)c(-n2nccn2)c1.Cc1ccc(C)c(-n2nccn2)c1.Cc1ccc(C)c(-n2nccn2)c1C.Cc1ccc(Cl)cc1-n1nccn1.Cc1ccc(F)cc1-n1nccn1.Cc1cccc(C)c1-n1nccn1.Cc1cccc(F)c1-n1nccn1.Cc1ccccc1-n1nccn1
InChIInChI=1S/2C11H13N3.C10H10FN3O.C10H10FN3.C10H11N3O.4C10H11N3.2C9H8ClN3.3C9H8FN3.C9H10N4.C9H9N3/c1-8-6-10(3)11(7-9(8)2)14-12-4-5-13-14;1-8-4-5-9(2)11(10(8)3)14-12-6-7-13-14;1-7-8(14-12-5-6-13-14)3-4-9(15-2)10(7)11;1-7-3-4-9(8(2)10(7)11)14-12-5-6-13-14;1-8-7-9(14-2)3-4-10(8)13-11-5-6-12-13;1-8-3-4-10(9(2)7-8)13-11-5-6-12-13;2*1-8-3-4-9(2)10(7-8)13-11-5-6-12-13;1-8-4-3-5-9(2)10(8)13-11-6-7-12-13;1-7-6-8(10)2-3-9(7)13-11-4-5-12-13;1-7-2-3-8(10)6-9(7)13-11-4-5-12-13;1-7-6-8(10)2-3-9(7)13-11-4-5-12-13;1-7-2-3-8(10)6-9(7)13-11-4-5-12-13;1-7-3-2-4-8(10)9(7)13-11-5-6-12-13;1-7-3-4-9(8(2)12-7)13-10-5-6-11-13;1-8-4-2-3-5-9(8)12-10-6-7-11-12/h2*4-7H,1-3H3;3-6H,1-2H3;3-6H,1-2H3;3-7H,1-2H3;4*3-7H,1-2H3;5*2-6H,1H3;3-6H,1-2H3;2-7H,1H3
InChIKeyRIYOPZBRNFZJLC-UHFFFAOYSA-N
XLogP29.71
TPSA522.71 Ų
H-Bond Donors
H-Bond Acceptors51
Rotatable Bonds18
Heavy Atoms213
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002907.22
LogP ≤ 529.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1051

Analyze 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole?
The IUPAC name of 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole (CID 160639298) is 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole.
What is the SMILES notation for 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole?
The canonical SMILES for 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole is COc1ccc(-n2nccn2)c(C)c1.COc1ccc(-n2nccn2)c(C)c1F.Cc1cc(C)c(-n2nccn2)cc1C.Cc1cc(Cl)ccc1-n1nccn1.Cc1cc(F)ccc1-n1nccn1.Cc1ccc(-n2nccn2)c(C)c1.Cc1ccc(-n2nccn2)c(C)c1F.Cc1ccc(-n2nccn2)c(C)n1.Cc1ccc(C)c(-n2nccn2)c1.Cc1ccc(C)c(-n2nccn2)c1.Cc1ccc(C)c(-n2nccn2)c1C.Cc1ccc(Cl)cc1-n1nccn1.Cc1ccc(F)cc1-n1nccn1.Cc1cccc(C)c1-n1nccn1.Cc1cccc(F)c1-n1nccn1.Cc1ccccc1-n1nccn1.
What is the InChIKey of 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole?
The InChIKey is RIYOPZBRNFZJLC-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H13N3.C10H10FN3O.C10H10FN3.C10H11N3O.4C10H11N3.2C9H8ClN3.3C9H8FN3.C9H10N4.C9H9N3/c1-8-6-10(3)11(7-9(8)2)14-12-4-5-13-14;1-8-4-5-9(2)11(10(8)3)14-12-6-7-13-14;1-7-8(14-12-5-6-13-14)3-4-9(15-2)10(7)11;1-7-3-4-9(8(2)10(7)11)14-12-5-6-13-14;1-8-7-9(14-2)3-4-10(8)13-11-5-6-12-13;1-8-3-4-10(9(2)7-8)13-11-5-6-12-13;2*1-8-3-4-9(2)10(7-8)13-11-5-6-12-13;1-8-4-3-5-9(2)10(8)13-11-6-7-12-13;1-7-6-8(10)2-3-9(7)13-11-4-5-12-13;1-7-2-3-8(10)6-9(7)13-11-4-5-12-13;1-7-6-8(10)2-3-9(7)13-11-4-5-12-13;1-7-2-3-8(10)6-9(7)13-11-4-5-12-13;1-7-3-2-4-8(10)9(7)13-11-5-6-12-13;1-7-3-4-9(8(2)12-7)13-10-5-6-11-13;1-8-4-2-3-5-9(8)12-10-6-7-11-12/h2*4-7H,1-3H3;3-6H,1-2H3;3-6H,1-2H3;3-7H,1-2H3;4*3-7H,1-2H3;5*2-6H,1H3;3-6H,1-2H3;2-7H,1H3.
What are the key properties of 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole?
2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole has a molecular weight of 2907.22 g/mol, XLogP of 29.71, 18 rotatable bonds, 0 hydrogen bond donors, and 51 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chloro-2-methylphenyl)triazole;2-(5-chloro-2-methylphenyl)triazole;2-(2,4-dimethylphenyl)triazole;bis(2-(2,5-dimethylphenyl)triazole);2-(2,6-dimethylphenyl)triazole;2,6-dimethyl-3-(triazol-2-yl)pyridine;2-(3-fluoro-2,4-dimethylphenyl)triazole;2-(3-fluoro-4-methoxy-2-methylphenyl)triazole;2-(2-fluoro-6-methylphenyl)triazole;2-(4-fluoro-2-methylphenyl)triazole;2-(5-fluoro-2-methylphenyl)triazole;2-(4-methoxy-2-methylphenyl)triazole;2-(2-methylphenyl)triazole;2-(2,3,6-trimethylphenyl)triazole;2-(2,4,5-trimethylphenyl)triazole is sourced from PubChem (CID 160639298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).