2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine

C11H11F6N — CID 150480476

IUPAC2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine
SMILESCc1nc(C)c(CC(F)(F)F)cc1CC(F)(F)F
InChIInChI=1S/C11H11F6N/c1-6-8(4-10(12,13)14)3-9(7(2)18-6)5-11(15,16)17/h3H,4-5H2,1-2H3
InChIKeyHTSFTMJNSUBPJI-UHFFFAOYSA-N
MW271.20 g/mol
LogP3.91
Rot. Bonds2

About 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine

2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine (PubChem CID 150480476) has the molecular formula C11H11F6N and a molecular weight of 271.20 g/mol. Its IUPAC name is 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine.

Molecular Properties

Compound Name2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine
PubChem CID150480476
Molecular FormulaC11H11F6N
Molecular Weight271.20 g/mol
Exact Mass271.08
IUPAC Name2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine
SMILESCc1nc(C)c(CC(F)(F)F)cc1CC(F)(F)F
InChIInChI=1S/C11H11F6N/c1-6-8(4-10(12,13)14)3-9(7(2)18-6)5-11(15,16)17/h3H,4-5H2,1-2H3
InChIKeyHTSFTMJNSUBPJI-UHFFFAOYSA-N
XLogP3.91
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.20
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4,6-dimethyl-5-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 166870865
2-[5-(cyanomethyl)-2,6-dimethyl-3-pyridinyl]acetonitrile
CID 68939181
8-(4-chloro-2,6-dimethylphenyl)-2-methyl-4-(2,2,2-trifluoroethyl)quinoline
CID 91279662
4-methyl-3-(2,2,2-trifluoroethyl)phenol
CID 16756490
5-ethyl-2,6-dimethylpyridin-3-ol
CID 10329448
2-ethyl-3-(2,2,2-trifluoroethyl)pyridine
CID 177328256
4-methyl-2-(2,2,2-trifluoroethyl)pyrimidin-5-amine
CID 84663024
4-chloro-2-ethyl-5-(2,2,2-trifluoroethyl)pyrimidine
CID 131115505
3-methyl-4-(2,2,2-trifluoroethyl)benzoic acid
CID 91883693
[5-methyl-2-(2,2,2-trifluoroethyl)pyrimidin-4-yl]methanol
CID 126975264
1-chloro-2-methoxy-4-methyl-5-(2,2,2-trifluoroethyl)benzene
CID 116932143
4,6-dichloro-5-(3-methylphenyl)-2-(2,2,2-trifluoroethyl)pyrimidine
CID 79416729

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine?
The IUPAC name of 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine (CID 150480476) is 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine.
What is the SMILES notation for 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine?
The canonical SMILES for 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine is Cc1nc(C)c(CC(F)(F)F)cc1CC(F)(F)F.
What is the InChIKey of 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine?
The InChIKey is HTSFTMJNSUBPJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F6N/c1-6-8(4-10(12,13)14)3-9(7(2)18-6)5-11(15,16)17/h3H,4-5H2,1-2H3.
What are the key properties of 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine?
2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine has a molecular weight of 271.20 g/mol, XLogP of 3.91, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-3,5-bis(2,2,2-trifluoroethyl)pyridine is sourced from PubChem (CID 150480476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).