1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol

C14H22O3 — CID 61080758

IUPAC1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol
SMILESCCCCC(O)c1cc(OC)c(OC)cc1C
InChIInChI=1S/C14H22O3/c1-5-6-7-12(15)11-9-14(17-4)13(16-3)8-10(11)2/h8-9,12,15H,5-7H2,1-4H3
InChIKeyFKQVWFSQMWBOJQ-UHFFFAOYSA-N
MW238.33 g/mol
LogP3.24
Rot. Bonds6

About 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol

1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol (PubChem CID 61080758) has the molecular formula C14H22O3 and a molecular weight of 238.33 g/mol. Its IUPAC name is 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol.

Molecular Properties

Compound Name1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol
PubChem CID61080758
Molecular FormulaC14H22O3
Molecular Weight238.33 g/mol
Exact Mass238.16
IUPAC Name1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol
SMILESCCCCC(O)c1cc(OC)c(OC)cc1C
InChIInChI=1S/C14H22O3/c1-5-6-7-12(15)11-9-14(17-4)13(16-3)8-10(11)2/h8-9,12,15H,5-7H2,1-4H3
InChIKeyFKQVWFSQMWBOJQ-UHFFFAOYSA-N
XLogP3.24
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4,5-dimethoxy-2-methylphenyl)hexan-1-ol
CID 61080760
1-(4,5-dimethoxy-2-methylphenyl)octane-1,8-diol
CID 166530640
1-(2-methoxy-5-methylphenyl)pentan-1-ol
CID 61080930
1-(1-bromooctyl)-4,5-dimethoxy-2-methylbenzene
CID 63443348
1-(2-fluoro-4,5-dimethoxyphenyl)heptan-1-ol
CID 114753416
1-(1-chlorooctyl)-4,5-dimethoxy-2-methylbenzene
CID 63435046
1-(5-bromo-2-methoxy-4-methylphenyl)decan-1-ol
CID 65433754
1-(4-methoxy-2,5-dimethylphenyl)-4-methylpentan-1-ol
CID 113370104
3-(ethylamino)-1-(4-methoxy-2,5-dimethylphenyl)propan-1-ol
CID 112510132
1-(4,5-dimethoxy-2-methylphenyl)-N-methyloctan-1-amine
CID 43626724
1-(4-bromo-2-methoxyphenyl)pentan-1-ol
CID 115783251
1-(2,5-dimethoxy-4-methylphenyl)propan-1-ol
CID 10703654

Frequently Asked Questions

What is the IUPAC name of 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol?
The IUPAC name of 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol (CID 61080758) is 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol.
What is the SMILES notation for 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol?
The canonical SMILES for 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol is CCCCC(O)c1cc(OC)c(OC)cc1C.
What is the InChIKey of 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol?
The InChIKey is FKQVWFSQMWBOJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22O3/c1-5-6-7-12(15)11-9-14(17-4)13(16-3)8-10(11)2/h8-9,12,15H,5-7H2,1-4H3.
What are the key properties of 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol?
1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol has a molecular weight of 238.33 g/mol, XLogP of 3.24, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol is sourced from PubChem (CID 61080758), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).