3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid

C15H11NO3S — CID 63338487

IUPAC3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid
SMILESO=C(O)c1sccc1OCc1ccc2ccccc2n1
InChIInChI=1S/C15H11NO3S/c17-15(18)14-13(7-8-20-14)19-9-11-6-5-10-3-1-2-4-12(10)16-11/h1-8H,9H2,(H,17,18)
InChIKeyFHQZKZNGGBYIGG-UHFFFAOYSA-N
MW285.32 g/mol
LogP3.57
Rot. Bonds4

About 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid

3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid (PubChem CID 63338487) has the molecular formula C15H11NO3S and a molecular weight of 285.32 g/mol. Its IUPAC name is 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid.

Molecular Properties

Compound Name3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid
PubChem CID63338487
Molecular FormulaC15H11NO3S
Molecular Weight285.32 g/mol
Exact Mass285.05
IUPAC Name3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid
SMILESO=C(O)c1sccc1OCc1ccc2ccccc2n1
InChIInChI=1S/C15H11NO3S/c17-15(18)14-13(7-8-20-14)19-9-11-6-5-10-3-1-2-4-12(10)16-11/h1-8H,9H2,(H,17,18)
InChIKeyFHQZKZNGGBYIGG-UHFFFAOYSA-N
XLogP3.57
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(2-phenyl-1,3-oxazol-4-yl)methoxy]thiophene-2-carboxylic acid
CID 63336486
4-methoxy-3-(quinolin-2-ylmethoxy)benzoic acid
CID 5074844
2-(quinolin-2-ylmethoxy)benzoate
CID 6919840
3-[(1-phenylpyrazol-3-yl)methoxy]thiophene-2-carboxylic acid
CID 63335925
4-[4-(quinolin-2-ylmethoxy)phenyl]benzoic acid
CID 168875197
3-[(2-acetamido-1,3-thiazol-4-yl)methoxy]thiophene-2-carboxylic acid
CID 55200988
3-[(5-phenyl-1,2,4-oxadiazol-3-yl)methoxy]thiophene-2-carboxylic acid
CID 63336257
2-chloro-5-(quinolin-2-ylmethoxy)benzoic acid
CID 110168584
3-[(6-fluoroquinolin-8-yl)methoxy]thiophene-2-carboxylic acid
CID 63336089
2-methyl-4-(quinolin-2-ylmethoxy)benzoic acid
CID 67896812
4-(quinolin-2-ylmethoxy)benzoyl chloride
CID 19762439
1-benzyl-1-[2-(quinolin-2-ylmethoxy)phenyl]hydrazine
CID 19814666

Frequently Asked Questions

What is the IUPAC name of 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid?
The IUPAC name of 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid (CID 63338487) is 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid.
What is the SMILES notation for 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid?
The canonical SMILES for 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid is O=C(O)c1sccc1OCc1ccc2ccccc2n1.
What is the InChIKey of 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid?
The InChIKey is FHQZKZNGGBYIGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11NO3S/c17-15(18)14-13(7-8-20-14)19-9-11-6-5-10-3-1-2-4-12(10)16-11/h1-8H,9H2,(H,17,18).
What are the key properties of 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid?
3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid has a molecular weight of 285.32 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(quinolin-2-ylmethoxy)thiophene-2-carboxylic acid is sourced from PubChem (CID 63338487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).