2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol

C13H20O3 — CID 117322308

IUPAC2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol
SMILESCCc1cc(C(C)CO)c(OC)cc1OC
InChIInChI=1S/C13H20O3/c1-5-10-6-11(9(2)8-14)13(16-4)7-12(10)15-3/h6-7,9,14H,5,8H2,1-4H3
InChIKeyNFUBIDRYRPARKU-UHFFFAOYSA-N
MW224.30 g/mol
LogP2.36
Rot. Bonds5

About 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol

2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol (PubChem CID 117322308) has the molecular formula C13H20O3 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol
PubChem CID117322308
Molecular FormulaC13H20O3
Molecular Weight224.30 g/mol
Exact Mass224.14
IUPAC Name2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol
SMILESCCc1cc(C(C)CO)c(OC)cc1OC
InChIInChI=1S/C13H20O3/c1-5-10-6-11(9(2)8-14)13(16-4)7-12(10)15-3/h6-7,9,14H,5,8H2,1-4H3
InChIKeyNFUBIDRYRPARKU-UHFFFAOYSA-N
XLogP2.36
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-ethyl-2-methoxy-5-methylsulfanylphenyl)propan-1-ol
CID 117353827
2-(5-ethyl-2-hydroxy-4-methoxyphenyl)propanoic acid
CID 84789679
2-[4-(dimethylamino)-2,5-dimethoxyphenyl]propan-1-ol
CID 117351358
2-(2-methoxy-4-methylphenyl)propan-1-ol
CID 14432753
2-(4-fluoro-2-methoxyphenyl)propan-1-ol
CID 105426240
2-[4,5-dimethoxy-2-(methoxymethyl)phenyl]propan-1-ol
CID 117353545
[2-fluoro-4-[(2R)-1-hydroxypropan-2-yl]-5-methoxyphenyl]boronic acid
CID 123951308
5-hydroxy-2-(1-hydroxypropan-2-yl)-4-methoxybenzaldehyde
CID 117300229
(2,4-dimethoxy-5-propan-2-ylphenyl)methanesulfonyl chloride
CID 117472731
2,5-diethyl-4-methoxyphenol
CID 162375149
1-bromo-5-ethyl-2,4-dimethoxybenzene
CID 58764118
2-[5-(difluoromethyl)-2,4-dimethoxyphenyl]ethanol
CID 117335907

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol?
The IUPAC name of 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol (CID 117322308) is 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol.
What is the SMILES notation for 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol?
The canonical SMILES for 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol is CCc1cc(C(C)CO)c(OC)cc1OC.
What is the InChIKey of 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol?
The InChIKey is NFUBIDRYRPARKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20O3/c1-5-10-6-11(9(2)8-14)13(16-4)7-12(10)15-3/h6-7,9,14H,5,8H2,1-4H3.
What are the key properties of 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol?
2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol has a molecular weight of 224.30 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethyl-2,4-dimethoxyphenyl)propan-1-ol is sourced from PubChem (CID 117322308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).