2,5-diethyl-4-propan-2-yloxyphenol

C13H20O2 — CID 162375189

IUPAC2,5-diethyl-4-propan-2-yloxyphenol
SMILESCCc1cc(OC(C)C)c(CC)cc1O
InChIInChI=1S/C13H20O2/c1-5-10-8-13(15-9(3)4)11(6-2)7-12(10)14/h7-9,14H,5-6H2,1-4H3
InChIKeyNEGAOFFIBOUBMG-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.30
Rot. Bonds4

About 2,5-diethyl-4-propan-2-yloxyphenol

2,5-diethyl-4-propan-2-yloxyphenol (PubChem CID 162375189) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 2,5-diethyl-4-propan-2-yloxyphenol.

Molecular Properties

Compound Name2,5-diethyl-4-propan-2-yloxyphenol
PubChem CID162375189
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name2,5-diethyl-4-propan-2-yloxyphenol
SMILESCCc1cc(OC(C)C)c(CC)cc1O
InChIInChI=1S/C13H20O2/c1-5-10-8-13(15-9(3)4)11(6-2)7-12(10)14/h7-9,14H,5-6H2,1-4H3
InChIKeyNEGAOFFIBOUBMG-UHFFFAOYSA-N
XLogP3.30
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-diethyl-4-methoxyphenol
CID 162375149
2,5-di(propan-2-yloxy)benzene-1,4-diol
CID 70497584
4-ethyl-5-propan-2-yloxy-1H-pyridin-2-one
CID 123704697
N-(3-ethyl-4-propan-2-yloxyphenyl)acetamide
CID 66916731
2-[4-chloro-2,5-di(propan-2-yloxy)phenyl]acetic acid
CID 82267978
3-propan-2-yloxy-4-propylphenol
CID 20571185
(4-chloro-2-fluoro-5-propan-2-yloxyphenyl)methanol
CID 21200446
1-ethyl-4-(2-methylpropoxy)-2-propan-2-yloxybenzene
CID 123447747
3-ethyl-2-methyl-4-propan-2-yloxyphenol
CID 162375077
2-ethyl-3,6-dimethyl-4-propan-2-yloxyphenol
CID 162375132
2-(2-fluoro-4-methoxy-5-propan-2-yloxyphenyl)acetic acid
CID 117357480
1-(5-ethoxy-4-ethyl-2-hydroxyphenyl)ethanone
CID 171033647

Frequently Asked Questions

What is the IUPAC name of 2,5-diethyl-4-propan-2-yloxyphenol?
The IUPAC name of 2,5-diethyl-4-propan-2-yloxyphenol (CID 162375189) is 2,5-diethyl-4-propan-2-yloxyphenol.
What is the SMILES notation for 2,5-diethyl-4-propan-2-yloxyphenol?
The canonical SMILES for 2,5-diethyl-4-propan-2-yloxyphenol is CCc1cc(OC(C)C)c(CC)cc1O.
What is the InChIKey of 2,5-diethyl-4-propan-2-yloxyphenol?
The InChIKey is NEGAOFFIBOUBMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-5-10-8-13(15-9(3)4)11(6-2)7-12(10)14/h7-9,14H,5-6H2,1-4H3.
What are the key properties of 2,5-diethyl-4-propan-2-yloxyphenol?
2,5-diethyl-4-propan-2-yloxyphenol has a molecular weight of 208.30 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-diethyl-4-propan-2-yloxyphenol is sourced from PubChem (CID 162375189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).