3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol

C14H22O2 — CID 65313856

IUPAC3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol
SMILESCCC(O)(c1ccc(OC)cc1C)C(C)C
InChIInChI=1S/C14H22O2/c1-6-14(15,10(2)3)13-8-7-12(16-5)9-11(13)4/h7-10,15H,6H2,1-5H3
InChIKeyJOZIPIRTRJJKPI-UHFFFAOYSA-N
MW222.33 g/mol
LogP3.26
Rot. Bonds4

About 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol

3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol (PubChem CID 65313856) has the molecular formula C14H22O2 and a molecular weight of 222.33 g/mol. Its IUPAC name is 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol.

Molecular Properties

Compound Name3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol
PubChem CID65313856
Molecular FormulaC14H22O2
Molecular Weight222.33 g/mol
Exact Mass222.16
IUPAC Name3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol
SMILESCCC(O)(c1ccc(OC)cc1C)C(C)C
InChIInChI=1S/C14H22O2/c1-6-14(15,10(2)3)13-8-7-12(16-5)9-11(13)4/h7-10,15H,6H2,1-5H3
InChIKeyJOZIPIRTRJJKPI-UHFFFAOYSA-N
XLogP3.26
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,4-dimethoxyphenyl)-2-methylpentan-3-ol
CID 62801618
3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-amine
CID 65313598
3-(3-methoxyphenyl)-2-methylpentan-3-ol;N-methylmethanamine
CID 68829384
1-(5-fluoro-2-pyridinyl)-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 115940675
3-(2,4-dimethoxyphenyl)pentan-3-ol
CID 62801128
1-(2-fluorophenyl)-1-(4-methoxy-2-methylphenyl)propan-1-amine
CID 115996402
4-methoxy-2-(2-methylbutan-2-yl)phenol
CID 11557455
1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 13147116
(2R)-1-(4-methoxy-2-methylphenyl)propan-2-ol
CID 97009148
1,1,1-trifluoro-2-[2-methyl-4-(2-methylpropoxy)phenyl]propan-2-ol
CID 83958506
4-methoxy-2-(4-methoxy-2-methylphenyl)butan-2-amine
CID 65313648
1-(4-methoxy-2-methylphenyl)-2-methylbutan-1-one
CID 65313346

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol?
The IUPAC name of 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol (CID 65313856) is 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol.
What is the SMILES notation for 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol?
The canonical SMILES for 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol is CCC(O)(c1ccc(OC)cc1C)C(C)C.
What is the InChIKey of 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol?
The InChIKey is JOZIPIRTRJJKPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O2/c1-6-14(15,10(2)3)13-8-7-12(16-5)9-11(13)4/h7-10,15H,6H2,1-5H3.
What are the key properties of 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol?
3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol has a molecular weight of 222.33 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxy-2-methylphenyl)-2-methylpentan-3-ol is sourced from PubChem (CID 65313856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).