1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol

C15H24O2 — CID 106682562

IUPAC1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol
SMILESCOc1cc(C)cc(C)c1C(O)C(C)C(C)C
InChIInChI=1S/C15H24O2/c1-9(2)12(5)15(16)14-11(4)7-10(3)8-13(14)17-6/h7-9,12,15-16H,1-6H3
InChIKeyVQXVUWLNGFNFKP-UHFFFAOYSA-N
MW236.35 g/mol
LogP3.64
Rot. Bonds4

About 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol

1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol (PubChem CID 106682562) has the molecular formula C15H24O2 and a molecular weight of 236.35 g/mol. Its IUPAC name is 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol.

Molecular Properties

Compound Name1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol
PubChem CID106682562
Molecular FormulaC15H24O2
Molecular Weight236.35 g/mol
Exact Mass236.18
IUPAC Name1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol
SMILESCOc1cc(C)cc(C)c1C(O)C(C)C(C)C
InChIInChI=1S/C15H24O2/c1-9(2)12(5)15(16)14-11(4)7-10(3)8-13(14)17-6/h7-9,12,15-16H,1-6H3
InChIKeyVQXVUWLNGFNFKP-UHFFFAOYSA-N
XLogP3.64
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.35
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-methoxy-1-(2-methoxy-4,6-dimethylphenyl)-2-phenylethanol
CID 106680320
(1R)-1-(2-methoxy-4,6-dimethylphenyl)-N-methylethanamine
CID 96670588
2-(3,5-dimethylphenyl)-1-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 106680174
2-ethyl-1-(2-methoxy-4,6-dimethylphenyl)hexan-1-ol
CID 106682520
2-[amino-(2-methoxy-4,6-dimethylphenyl)methyl]-3-methylbutan-1-ol
CID 116945650
2-amino-2-(2-methoxy-4,6-dimethylphenyl)ethanol
CID 77129779
3,3,3-trifluoro-1-(2-methoxy-4,6-dimethylphenyl)propan-1-ol
CID 106680156
cyclopentyl-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106679603
1-(2-methoxy-4,6-dimethylphenyl)-2-[(2-methylpropan-2-yl)oxy]ethanol
CID 106682653
N-ethyl-1-(2-methoxy-4,6-dimethylphenyl)ethanamine
CID 106680438
1-(2-methoxy-4,6-dimethylphenyl)ethanesulfonyl chloride
CID 116866342
1-(2-methoxy-4,6-dimethylphenyl)-2-(thian-4-yl)ethanol
CID 106682608

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol?
The IUPAC name of 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol (CID 106682562) is 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol.
What is the SMILES notation for 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol?
The canonical SMILES for 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol is COc1cc(C)cc(C)c1C(O)C(C)C(C)C.
What is the InChIKey of 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol?
The InChIKey is VQXVUWLNGFNFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O2/c1-9(2)12(5)15(16)14-11(4)7-10(3)8-13(14)17-6/h7-9,12,15-16H,1-6H3.
What are the key properties of 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol?
1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol has a molecular weight of 236.35 g/mol, XLogP of 3.64, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-4,6-dimethylphenyl)-2,3-dimethylbutan-1-ol is sourced from PubChem (CID 106682562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).