3-tert-butyl-2-ethylpyridine

C11H17N — CID 20664467

IUPAC3-tert-butyl-2-ethylpyridine
SMILESCCc1ncccc1C(C)(C)C
InChIInChI=1S/C11H17N/c1-5-10-9(11(2,3)4)7-6-8-12-10/h6-8H,5H2,1-4H3
InChIKeyJGHMKTPPDVMZKF-UHFFFAOYSA-N
MW163.26 g/mol
LogP2.94
Rot. Bonds1

About 3-tert-butyl-2-ethylpyridine

3-tert-butyl-2-ethylpyridine (PubChem CID 20664467) has the molecular formula C11H17N and a molecular weight of 163.26 g/mol. Its IUPAC name is 3-tert-butyl-2-ethylpyridine.

Molecular Properties

Compound Name3-tert-butyl-2-ethylpyridine
PubChem CID20664467
Molecular FormulaC11H17N
Molecular Weight163.26 g/mol
Exact Mass163.14
IUPAC Name3-tert-butyl-2-ethylpyridine
SMILESCCc1ncccc1C(C)(C)C
InChIInChI=1S/C11H17N/c1-5-10-9(11(2,3)4)7-6-8-12-10/h6-8H,5H2,1-4H3
InChIKeyJGHMKTPPDVMZKF-UHFFFAOYSA-N
XLogP2.94
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.26
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-diethylpyridine
CID 14747123
3-tert-butyl-2-(2,3,3-trimethylbutan-2-yl)pyridine
CID 122695001
2-(3-tert-butyl-2-pyridinyl)propan-2-ol
CID 166568505
3-tert-butyl-2-methylpyridine;ethane
CID 90980079
2-ethyl-3-(2,2,2-trifluoroethyl)pyridine
CID 177328256
N-[2-(2-ethyl-3-pyridinyl)ethyl]-2-methylpropan-2-amine
CID 155163873
N-ethyl-3-(trifluoromethyl)pyridin-2-amine
CID 23541253
(2-ethyl-3-pyridinyl)-imino-methyl-oxo-λ6-sulfane
CID 154975722
3-tert-butyl-5-[(3-tert-butyl-2-pyridinyl)methylperoxy]-2-methylpyridine
CID 167078384
3-(chloromethyl)-2-ethylpyridine;hydrochloride
CID 142546922
(3-tert-butyl-2-pyridinyl)boronic acid
CID 150712343
2-ethyl-3-isocyanopyridine
CID 157404495

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-2-ethylpyridine?
The IUPAC name of 3-tert-butyl-2-ethylpyridine (CID 20664467) is 3-tert-butyl-2-ethylpyridine.
What is the SMILES notation for 3-tert-butyl-2-ethylpyridine?
The canonical SMILES for 3-tert-butyl-2-ethylpyridine is CCc1ncccc1C(C)(C)C.
What is the InChIKey of 3-tert-butyl-2-ethylpyridine?
The InChIKey is JGHMKTPPDVMZKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N/c1-5-10-9(11(2,3)4)7-6-8-12-10/h6-8H,5H2,1-4H3.
What are the key properties of 3-tert-butyl-2-ethylpyridine?
3-tert-butyl-2-ethylpyridine has a molecular weight of 163.26 g/mol, XLogP of 2.94, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-2-ethylpyridine is sourced from PubChem (CID 20664467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).