ethane;5-methyl-2-(trifluoromethyl)pyridine

C11H18F3N — CID 143930819

IUPACethane;5-methyl-2-(trifluoromethyl)pyridine
SMILESCC.CC.Cc1ccc(C(F)(F)F)nc1
InChIInChI=1S/C7H6F3N.2C2H6/c1-5-2-3-6(11-4-5)7(8,9)10;2*1-2/h2-4H,1H3;2*1-2H3
InChIKeySVKXNZGOSVYBNR-UHFFFAOYSA-N
MW221.27 g/mol
LogP4.46
Rot. Bonds

About ethane;5-methyl-2-(trifluoromethyl)pyridine

ethane;5-methyl-2-(trifluoromethyl)pyridine (PubChem CID 143930819) has the molecular formula C11H18F3N and a molecular weight of 221.27 g/mol. Its IUPAC name is ethane;5-methyl-2-(trifluoromethyl)pyridine.

Molecular Properties

Compound Nameethane;5-methyl-2-(trifluoromethyl)pyridine
PubChem CID143930819
Molecular FormulaC11H18F3N
Molecular Weight221.27 g/mol
Exact Mass221.14
IUPAC Nameethane;5-methyl-2-(trifluoromethyl)pyridine
SMILESCC.CC.Cc1ccc(C(F)(F)F)nc1
InChIInChI=1S/C7H6F3N.2C2H6/c1-5-2-3-6(11-4-5)7(8,9)10;2*1-2/h2-4H,1H3;2*1-2H3
InChIKeySVKXNZGOSVYBNR-UHFFFAOYSA-N
XLogP4.46
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.27
LogP ≤ 54.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methylpyridine;5-methyl-2-(trifluoromethyl)pyridine
CID 143854771
5-[(4-methylphenoxy)methyl]-2-(trifluoromethyl)pyridine
CID 59391394
[(1R)-1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]azanium
CID 164715814
5-(1-iodoethyl)-2-(trifluoromethyl)pyridine
CID 142294771
5-ethoxy-2-(trifluoromethyl)pyridine
CID 126758289
5-propyl-2-(trifluoromethyl)pyridine
CID 23544356
5-(fluoromethyl)-2-(trifluoromethyl)pyridine
CID 177038549
2-(2,4-dimethylphenyl)-3,3-difluoro-3-(5-methyl-2-pyridinyl)propan-1-amine
CID 144927260
N-ethyl-6-(trifluoromethyl)pyridin-3-amine;4-methylbenzenesulfonic acid
CID 174705204
5-(2,3-dimethylbutan-2-yl)-2-(trifluoromethyl)pyridine
CID 146230452
acetic acid;6-(trifluoromethyl)pyridin-3-ol
CID 162333498
2-fluoro-5-methylpyridine
CID 2774635

Frequently Asked Questions

What is the IUPAC name of ethane;5-methyl-2-(trifluoromethyl)pyridine?
The IUPAC name of ethane;5-methyl-2-(trifluoromethyl)pyridine (CID 143930819) is ethane;5-methyl-2-(trifluoromethyl)pyridine.
What is the SMILES notation for ethane;5-methyl-2-(trifluoromethyl)pyridine?
The canonical SMILES for ethane;5-methyl-2-(trifluoromethyl)pyridine is CC.CC.Cc1ccc(C(F)(F)F)nc1.
What is the InChIKey of ethane;5-methyl-2-(trifluoromethyl)pyridine?
The InChIKey is SVKXNZGOSVYBNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F3N.2C2H6/c1-5-2-3-6(11-4-5)7(8,9)10;2*1-2/h2-4H,1H3;2*1-2H3.
What are the key properties of ethane;5-methyl-2-(trifluoromethyl)pyridine?
ethane;5-methyl-2-(trifluoromethyl)pyridine has a molecular weight of 221.27 g/mol, XLogP of 4.46, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5-methyl-2-(trifluoromethyl)pyridine is sourced from PubChem (CID 143930819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).