2-butyl-4-ethyl-6-propylphenol

C15H24O — CID 66988794

IUPAC2-butyl-4-ethyl-6-propylphenol
SMILESCCCCc1cc(CC)cc(CCC)c1O
InChIInChI=1S/C15H24O/c1-4-7-9-14-11-12(6-3)10-13(8-5-2)15(14)16/h10-11,16H,4-9H2,1-3H3
InChIKeyUGEUHNQEIFIZKX-UHFFFAOYSA-N
MW220.36 g/mol
LogP4.25
Rot. Bonds6

About 2-butyl-4-ethyl-6-propylphenol

2-butyl-4-ethyl-6-propylphenol (PubChem CID 66988794) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 2-butyl-4-ethyl-6-propylphenol.

Molecular Properties

Compound Name2-butyl-4-ethyl-6-propylphenol
PubChem CID66988794
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name2-butyl-4-ethyl-6-propylphenol
SMILESCCCCc1cc(CC)cc(CCC)c1O
InChIInChI=1S/C15H24O/c1-4-7-9-14-11-12(6-3)10-13(8-5-2)15(14)16/h10-11,16H,4-9H2,1-3H3
InChIKeyUGEUHNQEIFIZKX-UHFFFAOYSA-N
XLogP4.25
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-butyl-4-ethyl-6-propylphenol?
The IUPAC name of 2-butyl-4-ethyl-6-propylphenol (CID 66988794) is 2-butyl-4-ethyl-6-propylphenol.
What is the SMILES notation for 2-butyl-4-ethyl-6-propylphenol?
The canonical SMILES for 2-butyl-4-ethyl-6-propylphenol is CCCCc1cc(CC)cc(CCC)c1O.
What is the InChIKey of 2-butyl-4-ethyl-6-propylphenol?
The InChIKey is UGEUHNQEIFIZKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-4-7-9-14-11-12(6-3)10-13(8-5-2)15(14)16/h10-11,16H,4-9H2,1-3H3.
What are the key properties of 2-butyl-4-ethyl-6-propylphenol?
2-butyl-4-ethyl-6-propylphenol has a molecular weight of 220.36 g/mol, XLogP of 4.25, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-4-ethyl-6-propylphenol is sourced from PubChem (CID 66988794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).