4-methoxy-4-methyl-1-phenylpentan-1-ol

C13H20O2 — CID 103028375

IUPAC4-methoxy-4-methyl-1-phenylpentan-1-ol
SMILESCOC(C)(C)CCC(O)c1ccccc1
InChIInChI=1S/C13H20O2/c1-13(2,15-3)10-9-12(14)11-7-5-4-6-8-11/h4-8,12,14H,9-10H2,1-3H3
InChIKeyARYWUOJIMZTGRJ-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.93
Rot. Bonds5

About 4-methoxy-4-methyl-1-phenylpentan-1-ol

4-methoxy-4-methyl-1-phenylpentan-1-ol (PubChem CID 103028375) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 4-methoxy-4-methyl-1-phenylpentan-1-ol.

Molecular Properties

Compound Name4-methoxy-4-methyl-1-phenylpentan-1-ol
PubChem CID103028375
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name4-methoxy-4-methyl-1-phenylpentan-1-ol
SMILESCOC(C)(C)CCC(O)c1ccccc1
InChIInChI=1S/C13H20O2/c1-13(2,15-3)10-9-12(14)11-7-5-4-6-8-11/h4-8,12,14H,9-10H2,1-3H3
InChIKeyARYWUOJIMZTGRJ-UHFFFAOYSA-N
XLogP2.93
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-4-methoxy-4-methylpentan-1-ol
CID 103028171
4-methoxy-1-(4-methoxyphenyl)-4-methylpentan-1-ol
CID 103028229
1-(3-aminophenyl)-4-methoxy-4-methylpentan-1-ol
CID 106695946
5-methoxy-2,5-dimethyl-1-phenylhexan-1-ol
CID 103036478
7-methoxy-7-methyl-2-phenyloctan-4-ol
CID 103035120
4-methoxy-4-methyl-1-(1-phenylpyrazol-4-yl)pentan-1-ol
CID 103028464
1-(3-ethoxyphenyl)-4-methoxy-4-methylpentan-1-ol
CID 103035096
1-(2-iodophenyl)-4-methoxy-4-methylpentan-1-ol
CID 103028149
4-methoxy-4-methyl-1-thiophen-2-ylpentan-1-ol
CID 103028394
4-methoxy-1-(6-methoxy-3-pyridinyl)-4-methylpentan-1-ol
CID 103035297
1-(3-chloro-4-methoxyphenyl)-4-methoxy-4-methylpentan-1-ol
CID 103035148
1-(5-bromothiophen-3-yl)-4-methoxy-4-methylpentan-1-ol
CID 103028428

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-4-methyl-1-phenylpentan-1-ol?
The IUPAC name of 4-methoxy-4-methyl-1-phenylpentan-1-ol (CID 103028375) is 4-methoxy-4-methyl-1-phenylpentan-1-ol.
What is the SMILES notation for 4-methoxy-4-methyl-1-phenylpentan-1-ol?
The canonical SMILES for 4-methoxy-4-methyl-1-phenylpentan-1-ol is COC(C)(C)CCC(O)c1ccccc1.
What is the InChIKey of 4-methoxy-4-methyl-1-phenylpentan-1-ol?
The InChIKey is ARYWUOJIMZTGRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-13(2,15-3)10-9-12(14)11-7-5-4-6-8-11/h4-8,12,14H,9-10H2,1-3H3.
What are the key properties of 4-methoxy-4-methyl-1-phenylpentan-1-ol?
4-methoxy-4-methyl-1-phenylpentan-1-ol has a molecular weight of 208.30 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-4-methyl-1-phenylpentan-1-ol is sourced from PubChem (CID 103028375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).