2-(naphthalen-1-ylmethyl)thiophene

C15H12S — CID 23454862

IUPAC2-(naphthalen-1-ylmethyl)thiophene
SMILESc1csc(Cc2cccc3ccccc23)c1
InChIInChI=1S/C15H12S/c1-2-9-15-12(5-1)6-3-7-13(15)11-14-8-4-10-16-14/h1-10H,11H2
InChIKeyNWRUJLMCAJYJOX-UHFFFAOYSA-N
MW224.33 g/mol
LogP4.49
Rot. Bonds2

About 2-(naphthalen-1-ylmethyl)thiophene

2-(naphthalen-1-ylmethyl)thiophene (PubChem CID 23454862) has the molecular formula C15H12S and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-(naphthalen-1-ylmethyl)thiophene.

Molecular Properties

Compound Name2-(naphthalen-1-ylmethyl)thiophene
PubChem CID23454862
Molecular FormulaC15H12S
Molecular Weight224.33 g/mol
Exact Mass224.07
IUPAC Name2-(naphthalen-1-ylmethyl)thiophene
SMILESc1csc(Cc2cccc3ccccc23)c1
InChIInChI=1S/C15H12S/c1-2-9-15-12(5-1)6-3-7-13(15)11-14-8-4-10-16-14/h1-10H,11H2
InChIKeyNWRUJLMCAJYJOX-UHFFFAOYSA-N
XLogP4.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-naphthalen-1-yl-N-(thiophen-2-ylmethyl)methanamine;hydrochloride
CID 17289837
1-naphthalen-1-yl-3-thiophen-2-ylpropan-2-ol
CID 62606396
N-(naphthalen-1-ylmethyl)-2-thiophen-2-ylacetamide
CID 95960121
1-naphthalen-1-yl-4-thiophen-2-ylbutan-2-one
CID 105101445
CID 66760372
CID 66760372
sodium 2-(thiophen-2-ylmethyl)phenolate
CID 101328659
2-[(2,3-dimethylphenyl)methyl]thiophene
CID 54195522
2-[2-(thiophen-2-ylmethyl)phenyl]ethanol
CID 11252951
2-naphthalen-1-yl-N-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]acetamide
CID 7676413
N'-(2-naphthalen-1-ylacetyl)-3-thiophen-2-ylpropanehydrazide
CID 42386767
2-[(3-chloro-2-methylphenyl)methyl]thiophene
CID 174830599
2-methyl-3-(thiophen-2-ylmethyl)aniline
CID 39240617

Frequently Asked Questions

What is the IUPAC name of 2-(naphthalen-1-ylmethyl)thiophene?
The IUPAC name of 2-(naphthalen-1-ylmethyl)thiophene (CID 23454862) is 2-(naphthalen-1-ylmethyl)thiophene.
What is the SMILES notation for 2-(naphthalen-1-ylmethyl)thiophene?
The canonical SMILES for 2-(naphthalen-1-ylmethyl)thiophene is c1csc(Cc2cccc3ccccc23)c1.
What is the InChIKey of 2-(naphthalen-1-ylmethyl)thiophene?
The InChIKey is NWRUJLMCAJYJOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12S/c1-2-9-15-12(5-1)6-3-7-13(15)11-14-8-4-10-16-14/h1-10H,11H2.
What are the key properties of 2-(naphthalen-1-ylmethyl)thiophene?
2-(naphthalen-1-ylmethyl)thiophene has a molecular weight of 224.33 g/mol, XLogP of 4.49, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(naphthalen-1-ylmethyl)thiophene is sourced from PubChem (CID 23454862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).