2-naphthalen-2-yloxy-1-thiophen-2-ylethanone

C16H12O2S — CID 43413543

IUPAC2-naphthalen-2-yloxy-1-thiophen-2-ylethanone
SMILESO=C(COc1ccc2ccccc2c1)c1cccs1
InChIInChI=1S/C16H12O2S/c17-15(16-6-3-9-19-16)11-18-14-8-7-12-4-1-2-5-13(12)10-14/h1-10H,11H2
InChIKeyLQKXRHXMYPXMAW-UHFFFAOYSA-N
MW268.34 g/mol
LogP4.16
Rot. Bonds4

About 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone

2-naphthalen-2-yloxy-1-thiophen-2-ylethanone (PubChem CID 43413543) has the molecular formula C16H12O2S and a molecular weight of 268.34 g/mol. Its IUPAC name is 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone.

Molecular Properties

Compound Name2-naphthalen-2-yloxy-1-thiophen-2-ylethanone
PubChem CID43413543
Molecular FormulaC16H12O2S
Molecular Weight268.34 g/mol
Exact Mass268.06
IUPAC Name2-naphthalen-2-yloxy-1-thiophen-2-ylethanone
SMILESO=C(COc1ccc2ccccc2c1)c1cccs1
InChIInChI=1S/C16H12O2S/c17-15(16-6-3-9-19-16)11-18-14-8-7-12-4-1-2-5-13(12)10-14/h1-10H,11H2
InChIKeyLQKXRHXMYPXMAW-UHFFFAOYSA-N
XLogP4.16
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.34
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3,4-dimethylphenoxy)-1-thiophen-2-ylethanone
CID 43412330
2-(3,4-difluorophenoxy)-1-thiophen-2-ylethanone
CID 43612539
2-(3-chlorophenoxy)-1-thiophen-2-ylethanone
CID 60625787
2-(2,3-dihydro-1H-inden-5-yloxy)-1-thiophen-2-ylethanone
CID 43411849
2-(4-ethylphenoxy)-1-thiophen-2-ylethanone
CID 43412734
2-(4-nitrophenoxy)-1-thiophen-2-ylethanone
CID 60625574
2-[4-(2-oxo-2-thiophen-2-ylethoxy)phenyl]acetonitrile
CID 60624193
1-(2-bromophenyl)-2-naphthalen-2-yloxyethanone
CID 22123529
2-(2-phenoxyethoxy)-1-thiophen-2-ylethanone
CID 43798587
N-(3-hydroxy-3-thiophen-2-ylpropyl)-2-naphthalen-2-yloxyacetamide
CID 90524092
1-(3-bromophenyl)-2-naphthalen-2-yloxyethanone
CID 43413547
(2-oxo-2-thiophen-2-ylethyl) 4-(2-amino-2-oxoethoxy)benzoate
CID 8678423

Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone?
The IUPAC name of 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone (CID 43413543) is 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone.
What is the SMILES notation for 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone?
The canonical SMILES for 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone is O=C(COc1ccc2ccccc2c1)c1cccs1.
What is the InChIKey of 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone?
The InChIKey is LQKXRHXMYPXMAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12O2S/c17-15(16-6-3-9-19-16)11-18-14-8-7-12-4-1-2-5-13(12)10-14/h1-10H,11H2.
What are the key properties of 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone?
2-naphthalen-2-yloxy-1-thiophen-2-ylethanone has a molecular weight of 268.34 g/mol, XLogP of 4.16, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxy-1-thiophen-2-ylethanone is sourced from PubChem (CID 43413543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).