2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene

C14H16OS — CID 70158894

IUPAC2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene
SMILESCOc1ccc(CCc2cc(C)cs2)cc1
InChIInChI=1S/C14H16OS/c1-11-9-14(16-10-11)8-5-12-3-6-13(15-2)7-4-12/h3-4,6-7,9-10H,5,8H2,1-2H3
InChIKeyLBLUTGFVMKGLTJ-UHFFFAOYSA-N
MW232.35 g/mol
LogP3.85
Rot. Bonds4

About 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene

2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene (PubChem CID 70158894) has the molecular formula C14H16OS and a molecular weight of 232.35 g/mol. Its IUPAC name is 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene.

Molecular Properties

Compound Name2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene
PubChem CID70158894
Molecular FormulaC14H16OS
Molecular Weight232.35 g/mol
Exact Mass232.09
IUPAC Name2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene
SMILESCOc1ccc(CCc2cc(C)cs2)cc1
InChIInChI=1S/C14H16OS/c1-11-9-14(16-10-11)8-5-12-3-6-13(15-2)7-4-12/h3-4,6-7,9-10H,5,8H2,1-2H3
InChIKeyLBLUTGFVMKGLTJ-UHFFFAOYSA-N
XLogP3.85
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene 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

1-(4-bromothiophen-2-yl)-4-(4-methoxyphenyl)butan-2-amine
CID 115847825
3,5-bis[2-(4-methoxyphenyl)ethyl]phenol
CID 172870864
3-(4-methoxyphenyl)-N-[5-(4-methylthiophen-2-yl)-1,3,4-oxadiazol-2-yl]propanamide
CID 71781001
1-(2,5-dimethylfuran-3-yl)-3-(4-methoxyphenyl)propan-1-ol
CID 115803168
3-chloro-2-[1-chloro-3-(4-methoxyphenyl)propyl]thiophene
CID 80530344
3-(4-methoxyphenyl)-1-(5-methylthiophen-3-yl)propan-1-one
CID 114975974
1-methoxy-3-[2-(4-methoxyphenyl)ethyl]-5-[4-[2-(4-methoxyphenyl)ethyl]phenoxy]benzene
CID 172871171
N-[2-(4-chlorothiophen-2-yl)ethyl]-3-(4-methoxyphenyl)propanamide
CID 59820011
ethane;1-methoxy-4-propylbenzene
CID 142085762
1-[4,5-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]phenyl]-4,5-dimethoxy-2-[2-(4-methoxyphenyl)ethyl]benzene
CID 172870969
N'-[2-(4-methoxyphenyl)ethyl]-N-[2-(4-methylphenyl)ethyl]ethane-1,2-diamine
CID 23394676
N-[(4-bromothiophen-2-yl)methyl]-3-(4-methoxyphenyl)-N-methylpropanamide
CID 47042136

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene?
The IUPAC name of 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene (CID 70158894) is 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene.
What is the SMILES notation for 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene?
The canonical SMILES for 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene is COc1ccc(CCc2cc(C)cs2)cc1.
What is the InChIKey of 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene?
The InChIKey is LBLUTGFVMKGLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16OS/c1-11-9-14(16-10-11)8-5-12-3-6-13(15-2)7-4-12/h3-4,6-7,9-10H,5,8H2,1-2H3.
What are the key properties of 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene?
2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene has a molecular weight of 232.35 g/mol, XLogP of 3.85, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-methoxyphenyl)ethyl]-4-methylthiophene is sourced from PubChem (CID 70158894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).