5-methoxy-2-propylphenol

C10H14O2 — CID 12836519

IUPAC5-methoxy-2-propylphenol
SMILESCCCc1ccc(OC)cc1O
InChIInChI=1S/C10H14O2/c1-3-4-8-5-6-9(12-2)7-10(8)11/h5-7,11H,3-4H2,1-2H3
InChIKeyLLUJAKLTYYBSKA-UHFFFAOYSA-N
MW166.22 g/mol
LogP2.35
Rot. Bonds3

About 5-methoxy-2-propylphenol

5-methoxy-2-propylphenol (PubChem CID 12836519) has the molecular formula C10H14O2 and a molecular weight of 166.22 g/mol. Its IUPAC name is 5-methoxy-2-propylphenol.

Molecular Properties

Compound Name5-methoxy-2-propylphenol
PubChem CID12836519
Molecular FormulaC10H14O2
Molecular Weight166.22 g/mol
Exact Mass166.10
IUPAC Name5-methoxy-2-propylphenol
SMILESCCCc1ccc(OC)cc1O
InChIInChI=1S/C10H14O2/c1-3-4-8-5-6-9(12-2)7-10(8)11/h5-7,11H,3-4H2,1-2H3
InChIKeyLLUJAKLTYYBSKA-UHFFFAOYSA-N
XLogP2.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(ethylaminomethyl)-5-methoxyphenol
CID 39257600
2-(4,4-dimethylpentyl)-5-methoxyphenol
CID 146337312
2-[3-(dimethylamino)propyl]-5-methoxyphenol
CID 170865157
2-(aminomethyl)-5-methoxyphenol;ethane
CID 154662698
5-methoxy-2-[(4-methoxyphenoxy)methyl]phenol
CID 117221300
2-[(dimethylamino)methyl]-5-methoxyphenol
CID 18933640
5-methoxy-2-prop-2-enylphenol
CID 6424515
5-methoxy-2-[(4-methylphenoxy)methyl]phenol
CID 117221283
1-[2-(2-hydroxy-4-methoxyphenyl)ethyl]-2-methyl-3-pentylguanidine;hydroiodide
CID 111780582
ethane;5-fluoro-2-propylphenol
CID 143012210
2-chloro-N-[2-(2-hydroxy-4-methoxyphenyl)ethyl]propanamide
CID 82109866
1,2-dibutyl-4-methoxybenzene
CID 153315966

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-propylphenol?
The IUPAC name of 5-methoxy-2-propylphenol (CID 12836519) is 5-methoxy-2-propylphenol.
What is the SMILES notation for 5-methoxy-2-propylphenol?
The canonical SMILES for 5-methoxy-2-propylphenol is CCCc1ccc(OC)cc1O.
What is the InChIKey of 5-methoxy-2-propylphenol?
The InChIKey is LLUJAKLTYYBSKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O2/c1-3-4-8-5-6-9(12-2)7-10(8)11/h5-7,11H,3-4H2,1-2H3.
What are the key properties of 5-methoxy-2-propylphenol?
5-methoxy-2-propylphenol has a molecular weight of 166.22 g/mol, XLogP of 2.35, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-propylphenol is sourced from PubChem (CID 12836519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).