5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one

C14H11NO2S — CID 116626911

IUPAC5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one
SMILESO=c1c2ccsc2ccn1Cc1ccc(O)cc1
InChIInChI=1S/C14H11NO2S/c16-11-3-1-10(2-4-11)9-15-7-5-13-12(14(15)17)6-8-18-13/h1-8,16H,9H2
InChIKeyVIABPMUWJGJXKZ-UHFFFAOYSA-N
MW257.31 g/mol
LogP2.82
Rot. Bonds2

About 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one

5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one (PubChem CID 116626911) has the molecular formula C14H11NO2S and a molecular weight of 257.31 g/mol. Its IUPAC name is 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one.

Molecular Properties

Compound Name5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one
PubChem CID116626911
Molecular FormulaC14H11NO2S
Molecular Weight257.31 g/mol
Exact Mass257.05
IUPAC Name5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one
SMILESO=c1c2ccsc2ccn1Cc1ccc(O)cc1
InChIInChI=1S/C14H11NO2S/c16-11-3-1-10(2-4-11)9-15-7-5-13-12(14(15)17)6-8-18-13/h1-8,16H,9H2
InChIKeyVIABPMUWJGJXKZ-UHFFFAOYSA-N
XLogP2.82
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.31
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(4-bromophenyl)methyl]thieno[3,2-c]pyridin-4-one
CID 113347683
4-[(4-oxothieno[3,2-c]pyridin-5-yl)methyl]benzamide
CID 115886543
5-[(3,4-dimethoxyphenyl)methyl]thieno[3,2-c]pyridin-4-one
CID 103990875
5-ethylthieno[3,2-c]pyridin-4-one
CID 115886528
3-[(4-oxothieno[3,2-c]pyridin-5-yl)methyl]benzamide
CID 115886525
2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
CID 115886517
5-[(3-fluoro-4-nitrophenyl)methyl]thieno[3,2-c]pyridin-4-one
CID 115912029
3-(4-oxothieno[3,2-c]pyridin-5-yl)propanoic acid
CID 112556961
5-[(2-chloro-3-fluorophenyl)methyl]thieno[3,2-c]pyridin-4-one
CID 103985928
5-(5-hydroxypentyl)thieno[3,2-c]pyridin-4-one
CID 112557081
5-[(3-fluoro-5-nitrophenyl)methyl]thieno[3,2-c]pyridin-4-one
CID 116626859
5-[(E)-but-2-enyl]thieno[3,2-c]pyridin-4-one
CID 116626889

Frequently Asked Questions

What is the IUPAC name of 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one?
The IUPAC name of 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one (CID 116626911) is 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one.
What is the SMILES notation for 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one?
The canonical SMILES for 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one is O=c1c2ccsc2ccn1Cc1ccc(O)cc1.
What is the InChIKey of 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one?
The InChIKey is VIABPMUWJGJXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11NO2S/c16-11-3-1-10(2-4-11)9-15-7-5-13-12(14(15)17)6-8-18-13/h1-8,16H,9H2.
What are the key properties of 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one?
5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one has a molecular weight of 257.31 g/mol, XLogP of 2.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-hydroxyphenyl)methyl]thieno[3,2-c]pyridin-4-one is sourced from PubChem (CID 116626911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).