2-(4-tert-butylphenoxy)-5-methylpyridine

C16H19NO — CID 135299513

IUPAC2-(4-tert-butylphenoxy)-5-methylpyridine
SMILESCc1ccc(Oc2ccc(C(C)(C)C)cc2)nc1
InChIInChI=1S/C16H19NO/c1-12-5-10-15(17-11-12)18-14-8-6-13(7-9-14)16(2,3)4/h5-11H,1-4H3
InChIKeyZMXKMUDEJCYZAS-UHFFFAOYSA-N
MW241.33 g/mol
LogP4.48
Rot. Bonds2

About 2-(4-tert-butylphenoxy)-5-methylpyridine

2-(4-tert-butylphenoxy)-5-methylpyridine (PubChem CID 135299513) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-(4-tert-butylphenoxy)-5-methylpyridine.

Molecular Properties

Compound Name2-(4-tert-butylphenoxy)-5-methylpyridine
PubChem CID135299513
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-(4-tert-butylphenoxy)-5-methylpyridine
SMILESCc1ccc(Oc2ccc(C(C)(C)C)cc2)nc1
InChIInChI=1S/C16H19NO/c1-12-5-10-15(17-11-12)18-14-8-6-13(7-9-14)16(2,3)4/h5-11H,1-4H3
InChIKeyZMXKMUDEJCYZAS-UHFFFAOYSA-N
XLogP4.48
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 54.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-tert-butyl-2-(4-fluorophenoxy)pyridine
CID 69192638
5-tert-butyl-2-(4-chlorophenoxy)pyridine
CID 59464073
2-(3,4-dimethylphenoxy)-5-methylpyridine
CID 123670346
2-[4-(1-fluoroethoxy)phenoxy]-5-methylpyridine
CID 121391142
2-[6-(4-tert-butylphenoxy)-3-pyridinyl]ethanamine
CID 80640150
5-[(5-methyl-2-pyridinyl)oxy]pyrimidine
CID 123816421
2-fluoro-5-[(5-methyl-2-pyridinyl)oxy]pyridine
CID 146350052
6-(4-methylphenoxy)pyridin-3-amine
CID 4763818
5-[2-[6-(4-tert-butylphenoxy)-3-pyridinyl]ethyl]pyrimidin-2-amine
CID 164991107
2-(4-bromo-3-methylphenoxy)-5-methylpyridine
CID 83141020
4-(4-tert-butylphenoxy)-2-chloropyrimidine
CID 55065851
2-(4-tert-butylphenoxy)-6-methylpyrazine
CID 58432453

Frequently Asked Questions

What is the IUPAC name of 2-(4-tert-butylphenoxy)-5-methylpyridine?
The IUPAC name of 2-(4-tert-butylphenoxy)-5-methylpyridine (CID 135299513) is 2-(4-tert-butylphenoxy)-5-methylpyridine.
What is the SMILES notation for 2-(4-tert-butylphenoxy)-5-methylpyridine?
The canonical SMILES for 2-(4-tert-butylphenoxy)-5-methylpyridine is Cc1ccc(Oc2ccc(C(C)(C)C)cc2)nc1.
What is the InChIKey of 2-(4-tert-butylphenoxy)-5-methylpyridine?
The InChIKey is ZMXKMUDEJCYZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-12-5-10-15(17-11-12)18-14-8-6-13(7-9-14)16(2,3)4/h5-11H,1-4H3.
What are the key properties of 2-(4-tert-butylphenoxy)-5-methylpyridine?
2-(4-tert-butylphenoxy)-5-methylpyridine has a molecular weight of 241.33 g/mol, XLogP of 4.48, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylphenoxy)-5-methylpyridine is sourced from PubChem (CID 135299513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).