3-(cyclobutylmethoxy)-5-methylphenol

C12H16O2 — CID 107679985

IUPAC3-(cyclobutylmethoxy)-5-methylphenol
SMILESCc1cc(O)cc(OCC2CCC2)c1
InChIInChI=1S/C12H16O2/c1-9-5-11(13)7-12(6-9)14-8-10-3-2-4-10/h5-7,10,13H,2-4,8H2,1H3
InChIKeyBXNAXIUSXIFUKK-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.88
Rot. Bonds3

About 3-(cyclobutylmethoxy)-5-methylphenol

3-(cyclobutylmethoxy)-5-methylphenol (PubChem CID 107679985) has the molecular formula C12H16O2 and a molecular weight of 192.26 g/mol. Its IUPAC name is 3-(cyclobutylmethoxy)-5-methylphenol.

Molecular Properties

Compound Name3-(cyclobutylmethoxy)-5-methylphenol
PubChem CID107679985
Molecular FormulaC12H16O2
Molecular Weight192.26 g/mol
Exact Mass192.12
IUPAC Name3-(cyclobutylmethoxy)-5-methylphenol
SMILESCc1cc(O)cc(OCC2CCC2)c1
InChIInChI=1S/C12H16O2/c1-9-5-11(13)7-12(6-9)14-8-10-3-2-4-10/h5-7,10,13H,2-4,8H2,1H3
InChIKeyBXNAXIUSXIFUKK-UHFFFAOYSA-N
XLogP2.88
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-ethylcyclohexyl)oxy-5-methylphenol
CID 107680285
3-(cyclohexylmethoxy)-5-methylaniline
CID 112648470
1-(cyclohexylmethoxy)-3-methyl-5-propoxybenzene
CID 69097440
2-(cyclobutylmethoxy)-3,5-dimethylphenol
CID 84674450
4-[(3,5-dimethylphenoxy)methyl]thiane 1,1-dioxide
CID 126561186
3-chloro-2-(cyclobutylmethoxy)-5-methylphenol
CID 84690826
3-[3-(cyclohexylmethoxy)-5-methylphenyl]propan-1-amine
CID 170000630
3-fluoro-5-[[4-(trifluoromethyl)cyclohexyl]methoxy]phenol
CID 146557307
5-(cyclohexylmethoxy)-4-methylbenzene-1,3-diol
CID 175419611
3-amino-5-(oxan-4-ylmethoxy)phenol
CID 89063810
3-(3,3-dimethylbutoxy)-5-methylphenol
CID 107679623
3-methyl-5-prop-2-ynoxyphenol
CID 87477485

Frequently Asked Questions

What is the IUPAC name of 3-(cyclobutylmethoxy)-5-methylphenol?
The IUPAC name of 3-(cyclobutylmethoxy)-5-methylphenol (CID 107679985) is 3-(cyclobutylmethoxy)-5-methylphenol.
What is the SMILES notation for 3-(cyclobutylmethoxy)-5-methylphenol?
The canonical SMILES for 3-(cyclobutylmethoxy)-5-methylphenol is Cc1cc(O)cc(OCC2CCC2)c1.
What is the InChIKey of 3-(cyclobutylmethoxy)-5-methylphenol?
The InChIKey is BXNAXIUSXIFUKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O2/c1-9-5-11(13)7-12(6-9)14-8-10-3-2-4-10/h5-7,10,13H,2-4,8H2,1H3.
What are the key properties of 3-(cyclobutylmethoxy)-5-methylphenol?
3-(cyclobutylmethoxy)-5-methylphenol has a molecular weight of 192.26 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclobutylmethoxy)-5-methylphenol is sourced from PubChem (CID 107679985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).