4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol

C15H24O3 — CID 105116940

IUPAC4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol
SMILESCOC(C)CCC(O)c1ccccc1OC(C)C
InChIInChI=1S/C15H24O3/c1-11(2)18-15-8-6-5-7-13(15)14(16)10-9-12(3)17-4/h5-8,11-12,14,16H,9-10H2,1-4H3
InChIKeyAYQFZOKGJVCKES-UHFFFAOYSA-N
MW252.35 g/mol
LogP3.32
Rot. Bonds7

About 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol

4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol (PubChem CID 105116940) has the molecular formula C15H24O3 and a molecular weight of 252.35 g/mol. Its IUPAC name is 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol.

Molecular Properties

Compound Name4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol
PubChem CID105116940
Molecular FormulaC15H24O3
Molecular Weight252.35 g/mol
Exact Mass252.17
IUPAC Name4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol
SMILESCOC(C)CCC(O)c1ccccc1OC(C)C
InChIInChI=1S/C15H24O3/c1-11(2)18-15-8-6-5-7-13(15)14(16)10-9-12(3)17-4/h5-8,11-12,14,16H,9-10H2,1-4H3
InChIKeyAYQFZOKGJVCKES-UHFFFAOYSA-N
XLogP3.32
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.35
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-1-[2-(2-methoxyethoxy)phenyl]pentan-1-ol
CID 105125505
4-methoxy-1-(2-propan-2-yloxyphenyl)-N-propylpentan-1-amine
CID 105170923
2-(propan-2-ylamino)-1-(2-propan-2-yloxyphenyl)ethanol
CID 79023945
1-(2,3-difluorophenyl)-4-methoxypentan-1-ol
CID 105099608
1-(2-propan-2-yloxyphenyl)propane-1,2-diol
CID 103452569
1-(2-propan-2-yloxyphenyl)pentane-1,2-diol
CID 103454765
1-[2-(difluoromethoxy)phenyl]-5-methylhexan-1-ol
CID 83158841
3-chloro-1-(2-methoxyphenyl)propan-1-ol
CID 22621589
3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-pentadecafluoro-1-(2-propan-2-yloxyphenyl)nonan-1-ol
CID 156763821
2-(2,3-difluorophenyl)-1-(2-propan-2-yloxyphenyl)ethanol
CID 115823684
(1R)-4-chloro-1-(2-methoxyphenyl)butan-1-ol
CID 94256955
cyclooctyl-(2-propan-2-yloxyphenyl)methanol
CID 80603247

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol?
The IUPAC name of 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol (CID 105116940) is 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol.
What is the SMILES notation for 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol?
The canonical SMILES for 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol is COC(C)CCC(O)c1ccccc1OC(C)C.
What is the InChIKey of 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol?
The InChIKey is AYQFZOKGJVCKES-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O3/c1-11(2)18-15-8-6-5-7-13(15)14(16)10-9-12(3)17-4/h5-8,11-12,14,16H,9-10H2,1-4H3.
What are the key properties of 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol?
4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol has a molecular weight of 252.35 g/mol, XLogP of 3.32, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(2-propan-2-yloxyphenyl)pentan-1-ol is sourced from PubChem (CID 105116940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).