2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol

C15H24O2 — CID 162375124

IUPAC2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol
SMILESCCc1c(O)cc(C)c(OCC(C)C)c1CC
InChIInChI=1S/C15H24O2/c1-6-12-13(7-2)15(17-9-10(3)4)11(5)8-14(12)16/h8,10,16H,6-7,9H2,1-5H3
InChIKeyJXHOABGYUJJHLY-UHFFFAOYSA-N
MW236.35 g/mol
LogP3.86
Rot. Bonds5

About 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol

2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol (PubChem CID 162375124) has the molecular formula C15H24O2 and a molecular weight of 236.35 g/mol. Its IUPAC name is 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol.

Molecular Properties

Compound Name2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol
PubChem CID162375124
Molecular FormulaC15H24O2
Molecular Weight236.35 g/mol
Exact Mass236.18
IUPAC Name2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol
SMILESCCc1c(O)cc(C)c(OCC(C)C)c1CC
InChIInChI=1S/C15H24O2/c1-6-12-13(7-2)15(17-9-10(3)4)11(5)8-14(12)16/h8,10,16H,6-7,9H2,1-5H3
InChIKeyJXHOABGYUJJHLY-UHFFFAOYSA-N
XLogP3.86
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.35
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-diethyl-5-methyl-4-[(2-methylpropan-2-yl)oxy]phenol
CID 162375128
3,5-dimethyl-4-(2-methylpropoxy)benzonitrile
CID 65454303
3,5-dimethyl-2-(2-methylpropoxy)aniline
CID 54853227
3,4-dimethoxy-6-methyl-2-(2-methylpropoxy)phenol
CID 86195094
5-tert-butyl-1-fluoro-3-methyl-2-(2-methylpropoxy)benzene
CID 146426251
N-[[3,5-dimethyl-4-(2-methylpropoxy)phenyl]methyl]propan-1-amine
CID 43276745
1,3-dimethyl-2-(2-methylpropoxy)-5-prop-2-enylbenzene
CID 173371935
N-[[3,5-dimethyl-4-(2-methylpropoxy)phenyl]methyl]-2-methylpropan-1-amine
CID 63499791
2-ethyl-5-(4-ethyl-3-hydroxy-5-methylphenyl)-3-methylphenol
CID 134165367
2,4-dimethyl-6-(2-methylpropoxy)phenol
CID 171479386
2-[2-[3,5-dimethyl-2-(2-methylpropoxy)phenyl]butyl]propane-1,3-diamine
CID 83942296
2-[3,5-dimethyl-2-(2-methylpropoxy)phenyl]octane-4,5-diol
CID 83942398

Frequently Asked Questions

What is the IUPAC name of 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol?
The IUPAC name of 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol (CID 162375124) is 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol.
What is the SMILES notation for 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol?
The canonical SMILES for 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol is CCc1c(O)cc(C)c(OCC(C)C)c1CC.
What is the InChIKey of 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol?
The InChIKey is JXHOABGYUJJHLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O2/c1-6-12-13(7-2)15(17-9-10(3)4)11(5)8-14(12)16/h8,10,16H,6-7,9H2,1-5H3.
What are the key properties of 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol?
2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol has a molecular weight of 236.35 g/mol, XLogP of 3.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-diethyl-5-methyl-4-(2-methylpropoxy)phenol is sourced from PubChem (CID 162375124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).