3-[methoxy(diphenyl)methyl]thiophene

C18H16OS — CID 21049807

IUPAC3-[methoxy(diphenyl)methyl]thiophene
SMILESCOC(c1ccccc1)(c1ccccc1)c1ccsc1
InChIInChI=1S/C18H16OS/c1-19-18(17-12-13-20-14-17,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-14H,1H3
InChIKeySWVFKRHISICATK-UHFFFAOYSA-N
MW280.39 g/mol
LogP4.69
Rot. Bonds4

About 3-[methoxy(diphenyl)methyl]thiophene

3-[methoxy(diphenyl)methyl]thiophene (PubChem CID 21049807) has the molecular formula C18H16OS and a molecular weight of 280.39 g/mol. Its IUPAC name is 3-[methoxy(diphenyl)methyl]thiophene.

Molecular Properties

Compound Name3-[methoxy(diphenyl)methyl]thiophene
PubChem CID21049807
Molecular FormulaC18H16OS
Molecular Weight280.39 g/mol
Exact Mass280.09
IUPAC Name3-[methoxy(diphenyl)methyl]thiophene
SMILESCOC(c1ccccc1)(c1ccccc1)c1ccsc1
InChIInChI=1S/C18H16OS/c1-19-18(17-12-13-20-14-17,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-14H,1H3
InChIKeySWVFKRHISICATK-UHFFFAOYSA-N
XLogP4.69
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 54.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(4-aminophenyl)-methoxy-phenylmethyl]aniline
CID 102249306
1-phenyl-1-thiophen-3-ylpropan-1-amine
CID 65100038
2,2,2-trifluoro-1-phenyl-1-thiophen-3-ylethanol
CID 10611204
(2-hydroxy-2-phenyl-2-thiophen-3-ylethyl) acetate
CID 174712289
1-(2-methoxyphenyl)-1-thiophen-3-ylethanol
CID 65099719
1-(2-fluorophenyl)-1-thiophen-3-ylethanamine
CID 65099629
1-methoxy-1-phenylpropan-1-amine
CID 67818212
4-[methoxy(diphenyl)methyl]benzohydrazide
CID 70009539
3-(trifluoromethyl)thiophene
CID 2769441
2,3-dimethyl-3-thiophen-3-ylbutan-2-amine
CID 18719736
ethane;2-thiophen-3-ylpropan-2-ol
CID 144659448
3-tert-butylpyridine;3-tert-butylthiophene
CID 159689171

Frequently Asked Questions

What is the IUPAC name of 3-[methoxy(diphenyl)methyl]thiophene?
The IUPAC name of 3-[methoxy(diphenyl)methyl]thiophene (CID 21049807) is 3-[methoxy(diphenyl)methyl]thiophene.
What is the SMILES notation for 3-[methoxy(diphenyl)methyl]thiophene?
The canonical SMILES for 3-[methoxy(diphenyl)methyl]thiophene is COC(c1ccccc1)(c1ccccc1)c1ccsc1.
What is the InChIKey of 3-[methoxy(diphenyl)methyl]thiophene?
The InChIKey is SWVFKRHISICATK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16OS/c1-19-18(17-12-13-20-14-17,15-8-4-2-5-9-15)16-10-6-3-7-11-16/h2-14H,1H3.
What are the key properties of 3-[methoxy(diphenyl)methyl]thiophene?
3-[methoxy(diphenyl)methyl]thiophene has a molecular weight of 280.39 g/mol, XLogP of 4.69, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[methoxy(diphenyl)methyl]thiophene is sourced from PubChem (CID 21049807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).