5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane

C10H14ClN3 — CID 142337592

IUPAC5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane
SMILESCC.Cc1nc2ccc(C)c(Cl)n2n1
InChIInChI=1S/C8H8ClN3.C2H6/c1-5-3-4-7-10-6(2)11-12(7)8(5)9;1-2/h3-4H,1-2H3;1-2H3
InChIKeyQXYIUCYZCYJPNU-UHFFFAOYSA-N
MW211.70 g/mol
LogP3.03
Rot. Bonds

About 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane

5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane (PubChem CID 142337592) has the molecular formula C10H14ClN3 and a molecular weight of 211.70 g/mol. Its IUPAC name is 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane.

Molecular Properties

Compound Name5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane
PubChem CID142337592
Molecular FormulaC10H14ClN3
Molecular Weight211.70 g/mol
Exact Mass211.09
IUPAC Name5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane
SMILESCC.Cc1nc2ccc(C)c(Cl)n2n1
InChIInChI=1S/C8H8ClN3.C2H6/c1-5-3-4-7-10-6(2)11-12(7)8(5)9;1-2/h3-4H,1-2H3;1-2H3
InChIKeyQXYIUCYZCYJPNU-UHFFFAOYSA-N
XLogP3.03
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.70
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methyl 2-methyl-[1,2,4]triazolo[1,5-a]pyridine-5-carboxylate
CID 66720768
7-chloro-2,4,5-trimethylpyrrolo[2,1-f][1,2,4]triazine
CID 163275399
8-chloro-2,7-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane
CID 142337568
5,7-dichloro-2-methyl-6-phenyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 86630680
2-chloro-3,6-dimethylphenol;ethane
CID 144511181
5-(7-chloro-1H-indazol-5-yl)-2-methyl-6-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridine
CID 134457793
2,7-dimethyl-[1,2,4]triazolo[1,5-c]pyrimidin-5-amine
CID 12603825
2-(difluoromethyl)-3,6-dimethylimidazo[1,2-b]pyridazine;ethane
CID 144895132
3-tert-butyl-6-chloro-2-methylimidazo[1,2-b]pyridazine
CID 154620858
6-chloro-3-methylimidazo[1,2-b]pyridazine-2-carbonitrile
CID 90135335
2-methyl-5-[3-(trifluoromethyl)phenyl]-[1,2,4]triazolo[1,5-c]pyrimidine
CID 23459935
2-methyl-[1,2,4]triazolo[1,5-a]pyridine-6-sulfonyl chloride
CID 83823970

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane?
The IUPAC name of 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane (CID 142337592) is 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane.
What is the SMILES notation for 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane?
The canonical SMILES for 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane is CC.Cc1nc2ccc(C)c(Cl)n2n1.
What is the InChIKey of 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane?
The InChIKey is QXYIUCYZCYJPNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3.C2H6/c1-5-3-4-7-10-6(2)11-12(7)8(5)9;1-2/h3-4H,1-2H3;1-2H3.
What are the key properties of 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane?
5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane has a molecular weight of 211.70 g/mol, XLogP of 3.03, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2,6-dimethyl-[1,2,4]triazolo[1,5-a]pyridine;ethane is sourced from PubChem (CID 142337592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).