1-(2-methoxy-5-methylphenyl)pentan-1-ol

C13H20O2 — CID 61080930

IUPAC1-(2-methoxy-5-methylphenyl)pentan-1-ol
SMILESCCCCC(O)c1cc(C)ccc1OC
InChIInChI=1S/C13H20O2/c1-4-5-6-12(14)11-9-10(2)7-8-13(11)15-3/h7-9,12,14H,4-6H2,1-3H3
InChIKeyWAJQBDKNLWNPPI-UHFFFAOYSA-N
MW208.30 g/mol
LogP3.23
Rot. Bonds5

About 1-(2-methoxy-5-methylphenyl)pentan-1-ol

1-(2-methoxy-5-methylphenyl)pentan-1-ol (PubChem CID 61080930) has the molecular formula C13H20O2 and a molecular weight of 208.30 g/mol. Its IUPAC name is 1-(2-methoxy-5-methylphenyl)pentan-1-ol.

Molecular Properties

Compound Name1-(2-methoxy-5-methylphenyl)pentan-1-ol
PubChem CID61080930
Molecular FormulaC13H20O2
Molecular Weight208.30 g/mol
Exact Mass208.15
IUPAC Name1-(2-methoxy-5-methylphenyl)pentan-1-ol
SMILESCCCCC(O)c1cc(C)ccc1OC
InChIInChI=1S/C13H20O2/c1-4-5-6-12(14)11-9-10(2)7-8-13(11)15-3/h7-9,12,14H,4-6H2,1-3H3
InChIKeyWAJQBDKNLWNPPI-UHFFFAOYSA-N
XLogP3.23
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 ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methoxy-5-methylphenyl)decan-1-ol
CID 65427724
1,2-bis(2-methoxy-5-methylphenyl)ethanol
CID 115781516
methyl 4-hydroxy-4-(2-methoxy-5-methylphenyl)butanoate
CID 82347001
1-(2-methoxy-5-methylphenyl)decan-1-amine
CID 65449338
1-(2-methoxy-5-methylphenyl)undecan-1-amine
CID 115845828
3-hydroxy-3-(2-methoxy-5-methylphenyl)propanoic acid
CID 82366721
2-(1-chlorodecyl)-1-methoxy-4-methylbenzene
CID 65428310
3-[bis(2-methoxyethyl)amino]-1-(2-methoxy-5-methylphenyl)propan-1-ol
CID 82073888
1-(4,5-dimethoxy-2-methylphenyl)pentan-1-ol
CID 61080758
1-(aziridin-1-yl)-5-hydroxy-5-(2-methoxy-5-methylphenyl)pentan-1-one
CID 112510811
ethyl 2-hydroxy-2-(2-methoxy-5-methylphenyl)acetate
CID 10775496
3-amino-1-(2-methoxy-5-methylphenyl)butan-1-ol
CID 81462431

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxy-5-methylphenyl)pentan-1-ol?
The IUPAC name of 1-(2-methoxy-5-methylphenyl)pentan-1-ol (CID 61080930) is 1-(2-methoxy-5-methylphenyl)pentan-1-ol.
What is the SMILES notation for 1-(2-methoxy-5-methylphenyl)pentan-1-ol?
The canonical SMILES for 1-(2-methoxy-5-methylphenyl)pentan-1-ol is CCCCC(O)c1cc(C)ccc1OC.
What is the InChIKey of 1-(2-methoxy-5-methylphenyl)pentan-1-ol?
The InChIKey is WAJQBDKNLWNPPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O2/c1-4-5-6-12(14)11-9-10(2)7-8-13(11)15-3/h7-9,12,14H,4-6H2,1-3H3.
What are the key properties of 1-(2-methoxy-5-methylphenyl)pentan-1-ol?
1-(2-methoxy-5-methylphenyl)pentan-1-ol has a molecular weight of 208.30 g/mol, XLogP of 3.23, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxy-5-methylphenyl)pentan-1-ol is sourced from PubChem (CID 61080930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).