1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone

C9H8N2OS — CID 82402692

IUPAC1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone
SMILESCC(=O)c1cc2c(N)cncc2s1
InChIInChI=1S/C9H8N2OS/c1-5(12)8-2-6-7(10)3-11-4-9(6)13-8/h2-4H,10H2,1H3
InChIKeySNVZUGPMPSYYKR-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.08
Rot. Bonds1

About 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone

1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone (PubChem CID 82402692) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone.

Molecular Properties

Compound Name1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone
PubChem CID82402692
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone
SMILESCC(=O)c1cc2c(N)cncc2s1
InChIInChI=1S/C9H8N2OS/c1-5(12)8-2-6-7(10)3-11-4-9(6)13-8/h2-4H,10H2,1H3
InChIKeySNVZUGPMPSYYKR-UHFFFAOYSA-N
XLogP2.08
TPSA55.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone?
The IUPAC name of 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone (CID 82402692) is 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone.
What is the SMILES notation for 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone?
The canonical SMILES for 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone is CC(=O)c1cc2c(N)cncc2s1.
What is the InChIKey of 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone?
The InChIKey is SNVZUGPMPSYYKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c1-5(12)8-2-6-7(10)3-11-4-9(6)13-8/h2-4H,10H2,1H3.
What are the key properties of 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone?
1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone has a molecular weight of 192.24 g/mol, XLogP of 2.08, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminothieno[2,3-c]pyridin-2-yl)ethanone is sourced from PubChem (CID 82402692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).