3-ethylthieno[2,3-b]pyridine-2-carbaldehyde

C10H9NOS — CID 82374274

IUPAC3-ethylthieno[2,3-b]pyridine-2-carbaldehyde
SMILESCCc1c(C=O)sc2ncccc12
InChIInChI=1S/C10H9NOS/c1-2-7-8-4-3-5-11-10(8)13-9(7)6-12/h3-6H,2H2,1H3
InChIKeyRHHIEJIJCGVRSG-UHFFFAOYSA-N
MW191.26 g/mol
LogP2.67
Rot. Bonds2

About 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde

3-ethylthieno[2,3-b]pyridine-2-carbaldehyde (PubChem CID 82374274) has the molecular formula C10H9NOS and a molecular weight of 191.26 g/mol. Its IUPAC name is 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde.

Molecular Properties

Compound Name3-ethylthieno[2,3-b]pyridine-2-carbaldehyde
PubChem CID82374274
Molecular FormulaC10H9NOS
Molecular Weight191.26 g/mol
Exact Mass191.04
IUPAC Name3-ethylthieno[2,3-b]pyridine-2-carbaldehyde
SMILESCCc1c(C=O)sc2ncccc12
InChIInChI=1S/C10H9NOS/c1-2-7-8-4-3-5-11-10(8)13-9(7)6-12/h3-6H,2H2,1H3
InChIKeyRHHIEJIJCGVRSG-UHFFFAOYSA-N
XLogP2.67
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.26
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

3-methylthieno[2,3-b]pyridine-2-carbaldehyde
CID 82374291
3-ethyl-1-benzothiophene-2-carbaldehyde
CID 82374273
3-ethylthieno[2,3-c]pyridine-2-carbaldehyde
CID 82374277
3-ethyl-7-methyl-1-benzothiophene-2-carbaldehyde
CID 131124494
3-aminothieno[2,3-b]pyridine-2-carbaldehyde;aniline
CID 143488204
3-ethyl-6-methyl-1-benzothiophene-2-carbaldehyde
CID 131078285
2-methylsulfinyl-3-propylthiopyrano[2,3-b]pyridin-4-one
CID 117062550
6-ethyl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6,10,12-hexaene
CID 71072826
2-(ethylamino)pyridine-3-carbaldehyde
CID 15561922
3-oct-2-en-3-yl-2-prop-1-enylthieno[2,3-b]pyridine;hydroiodide
CID 173300657
6-ethenyl-5-ethylquinoline
CID 166703553
1-[amino(propyl)amino]thieno[3,2-f]quinoline-2-carbaldehyde
CID 118975129

Frequently Asked Questions

What is the IUPAC name of 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde?
The IUPAC name of 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde (CID 82374274) is 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde.
What is the SMILES notation for 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde?
The canonical SMILES for 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde is CCc1c(C=O)sc2ncccc12.
What is the InChIKey of 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde?
The InChIKey is RHHIEJIJCGVRSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NOS/c1-2-7-8-4-3-5-11-10(8)13-9(7)6-12/h3-6H,2H2,1H3.
What are the key properties of 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde?
3-ethylthieno[2,3-b]pyridine-2-carbaldehyde has a molecular weight of 191.26 g/mol, XLogP of 2.67, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylthieno[2,3-b]pyridine-2-carbaldehyde is sourced from PubChem (CID 82374274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).