2-butyl-3-chloro-5-(trifluoromethyl)pyridine

C10H11ClF3N — CID 68842183

IUPAC2-butyl-3-chloro-5-(trifluoromethyl)pyridine
SMILESCCCCc1ncc(C(F)(F)F)cc1Cl
InChIInChI=1S/C10H11ClF3N/c1-2-3-4-9-8(11)5-7(6-15-9)10(12,13)14/h5-6H,2-4H2,1H3
InChIKeyDYSPZRYDDIEFMO-UHFFFAOYSA-N
MW237.65 g/mol
LogP4.10
Rot. Bonds3

About 2-butyl-3-chloro-5-(trifluoromethyl)pyridine

2-butyl-3-chloro-5-(trifluoromethyl)pyridine (PubChem CID 68842183) has the molecular formula C10H11ClF3N and a molecular weight of 237.65 g/mol. Its IUPAC name is 2-butyl-3-chloro-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-butyl-3-chloro-5-(trifluoromethyl)pyridine
PubChem CID68842183
Molecular FormulaC10H11ClF3N
Molecular Weight237.65 g/mol
Exact Mass237.05
IUPAC Name2-butyl-3-chloro-5-(trifluoromethyl)pyridine
SMILESCCCCc1ncc(C(F)(F)F)cc1Cl
InChIInChI=1S/C10H11ClF3N/c1-2-3-4-9-8(11)5-7(6-15-9)10(12,13)14/h5-6H,2-4H2,1H3
InChIKeyDYSPZRYDDIEFMO-UHFFFAOYSA-N
XLogP4.10
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.65
LogP ≤ 54.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethylazanium chloride
CID 22637222
2-but-3-ynyl-3-chloro-5-(trifluoromethyl)pyridine
CID 166452013
3-chloro-2-[2-(2-chlorophenyl)ethyl]-5-(trifluoromethyl)pyridine
CID 134966661
3-chloro-2-nonan-5-yl-5-(trifluoromethyl)pyridine
CID 170266507
2-[3-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]propyl]isoindole-1,3-dione
CID 68783163
3-chloro-2-ethoxy-5-(trifluoromethyl)pyridine
CID 71058681
3-butyl-5-(trifluoromethyl)pyridin-2-amine
CID 150650764
2-chloro-N-[2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethyl]acetamide
CID 53405659
3-ethyl-2-propyl-5-(trifluoromethyl)pyridine
CID 144510564
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(cyclopropylmethyl)ethanamine
CID 134569795
2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]ethanethioamide
CID 91664064
2-chloro-5-[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]methyl]aniline
CID 150376040

Frequently Asked Questions

What is the IUPAC name of 2-butyl-3-chloro-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-butyl-3-chloro-5-(trifluoromethyl)pyridine (CID 68842183) is 2-butyl-3-chloro-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-butyl-3-chloro-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-butyl-3-chloro-5-(trifluoromethyl)pyridine is CCCCc1ncc(C(F)(F)F)cc1Cl.
What is the InChIKey of 2-butyl-3-chloro-5-(trifluoromethyl)pyridine?
The InChIKey is DYSPZRYDDIEFMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClF3N/c1-2-3-4-9-8(11)5-7(6-15-9)10(12,13)14/h5-6H,2-4H2,1H3.
What are the key properties of 2-butyl-3-chloro-5-(trifluoromethyl)pyridine?
2-butyl-3-chloro-5-(trifluoromethyl)pyridine has a molecular weight of 237.65 g/mol, XLogP of 4.10, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-3-chloro-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 68842183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).