4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one

C14H11NO2S — CID 14001220

IUPAC4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one
SMILESCOc1c(-c2ccsc2)c(=O)[nH]c2ccccc12
InChIInChI=1S/C14H11NO2S/c1-17-13-10-4-2-3-5-11(10)15-14(16)12(13)9-6-7-18-8-9/h2-8H,1H3,(H,15,16)
InChIKeyJXOFOYVLOYWEDG-UHFFFAOYSA-N
MW257.31 g/mol
LogP3.27
Rot. Bonds2

About 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one

4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one (PubChem CID 14001220) has the molecular formula C14H11NO2S and a molecular weight of 257.31 g/mol. Its IUPAC name is 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one.

Molecular Properties

Compound Name4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one
PubChem CID14001220
Molecular FormulaC14H11NO2S
Molecular Weight257.31 g/mol
Exact Mass257.05
IUPAC Name4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one
SMILESCOc1c(-c2ccsc2)c(=O)[nH]c2ccccc12
InChIInChI=1S/C14H11NO2S/c1-17-13-10-4-2-3-5-11(10)15-14(16)12(13)9-6-7-18-8-9/h2-8H,1H3,(H,15,16)
InChIKeyJXOFOYVLOYWEDG-UHFFFAOYSA-N
XLogP3.27
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 57412548
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3-[(3,3-dimethyloxiran-2-yl)methyl]-4-methoxy-1H-quinolin-2-one
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8,9-dimethoxy-5H-phenanthridin-6-one
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4-amino-3-phenyl-1H-quinolin-2-one
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4-phenylmethoxy-3-thiophen-2-yl-1H-quinolin-2-one
CID 50916853
(2-oxo-3-phenyl-1H-quinolin-4-yl) 4-methylbenzenesulfinate
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3,4-bis(2-methoxyethoxy)-1H-quinolin-2-one
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3-methoxy-2-nitro-1H-indole
CID 66764550
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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one?
The IUPAC name of 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one (CID 14001220) is 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one.
What is the SMILES notation for 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one?
The canonical SMILES for 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one is COc1c(-c2ccsc2)c(=O)[nH]c2ccccc12.
What is the InChIKey of 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one?
The InChIKey is JXOFOYVLOYWEDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO2S/c1-17-13-10-4-2-3-5-11(10)15-14(16)12(13)9-6-7-18-8-9/h2-8H,1H3,(H,15,16).
What are the key properties of 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one?
4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one has a molecular weight of 257.31 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-3-thiophen-3-yl-1H-quinolin-2-one is sourced from PubChem (CID 14001220), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).