3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol

C12H17FO2 — CID 117303114

IUPAC3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol
SMILESCCc1cc(CCCO)c(OC)cc1F
InChIInChI=1S/C12H17FO2/c1-3-9-7-10(5-4-6-14)12(15-2)8-11(9)13/h7-8,14H,3-6H2,1-2H3
InChIKeyRAAKQOCWZXROMB-UHFFFAOYSA-N
MW212.26 g/mol
LogP2.32
Rot. Bonds5

About 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol

3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol (PubChem CID 117303114) has the molecular formula C12H17FO2 and a molecular weight of 212.26 g/mol. Its IUPAC name is 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol.

Molecular Properties

Compound Name3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol
PubChem CID117303114
Molecular FormulaC12H17FO2
Molecular Weight212.26 g/mol
Exact Mass212.12
IUPAC Name3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol
SMILESCCc1cc(CCCO)c(OC)cc1F
InChIInChI=1S/C12H17FO2/c1-3-9-7-10(5-4-6-14)12(15-2)8-11(9)13/h7-8,14H,3-6H2,1-2H3
InChIKeyRAAKQOCWZXROMB-UHFFFAOYSA-N
XLogP2.32
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.26
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-fluoro-5-(3-hydroxypropyl)-4-methoxyphenol
CID 117289231
3-(4-ethyl-2-methoxy-5-methylsulfanylphenyl)propan-1-ol
CID 117353833
1-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-2-ol
CID 117303123
3-(5-ethyl-2-methoxyphenyl)propan-1-ol
CID 94680036
3-(4-ethyl-3-fluoro-5-methoxyphenyl)propan-1-ol
CID 117303122
3-(2-chloro-5-fluoro-3-methoxyphenyl)propan-1-ol
CID 117311669
3-(3-chloro-5-ethyl-2,4-dimethoxyphenyl)propan-1-ol
CID 117400675
3-(6-methoxy-2,3-dihydro-1H-inden-5-yl)propan-1-ol
CID 117294969
ethane;1-ethyl-5-fluoro-2-methoxy-4-propylbenzene
CID 168958922
1-bromo-4-ethyl-5-fluoro-2-methoxybenzene
CID 144671819
4-(4-chloro-2-methoxyphenyl)butan-1-ol
CID 59192502
2-bromo-4-fluoro-3-(3-hydroxypropyl)-6-methoxyphenol
CID 117447283

Frequently Asked Questions

What is the IUPAC name of 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol?
The IUPAC name of 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol (CID 117303114) is 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol.
What is the SMILES notation for 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol?
The canonical SMILES for 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol is CCc1cc(CCCO)c(OC)cc1F.
What is the InChIKey of 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol?
The InChIKey is RAAKQOCWZXROMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FO2/c1-3-9-7-10(5-4-6-14)12(15-2)8-11(9)13/h7-8,14H,3-6H2,1-2H3.
What are the key properties of 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol?
3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol has a molecular weight of 212.26 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethyl-4-fluoro-2-methoxyphenyl)propan-1-ol is sourced from PubChem (CID 117303114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).