7-aminothieno[2,3-b]pyrazine-6-carbaldehyde

C7H5N3OS — CID 25228189

IUPAC7-aminothieno[2,3-b]pyrazine-6-carbaldehyde
SMILESNc1c(C=O)sc2nccnc12
InChIInChI=1S/C7H5N3OS/c8-5-4(3-11)12-7-6(5)9-1-2-10-7/h1-3H,8H2
InChIKeyDODAPIKZERXETF-UHFFFAOYSA-N
MW179.20 g/mol
LogP1.09
Rot. Bonds1

About 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde

7-aminothieno[2,3-b]pyrazine-6-carbaldehyde (PubChem CID 25228189) has the molecular formula C7H5N3OS and a molecular weight of 179.20 g/mol. Its IUPAC name is 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde.

Molecular Properties

Compound Name7-aminothieno[2,3-b]pyrazine-6-carbaldehyde
PubChem CID25228189
Molecular FormulaC7H5N3OS
Molecular Weight179.20 g/mol
Exact Mass179.02
IUPAC Name7-aminothieno[2,3-b]pyrazine-6-carbaldehyde
SMILESNc1c(C=O)sc2nccnc12
InChIInChI=1S/C7H5N3OS/c8-5-4(3-11)12-7-6(5)9-1-2-10-7/h1-3H,8H2
InChIKeyDODAPIKZERXETF-UHFFFAOYSA-N
XLogP1.09
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.20
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

7-Aminothieno[2,3-b]pyrazine-6-carboxylic acid
CID 12225712
Methyl 7-aminothieno[2,3-b]pyrazine-6-carboxylate
CID 2759783
Thieno[2,3-b]pyrazine-6-carbaldehyde
CID 7537492
Ethyl 7-aminothieno[2,3-b]pyrazine-6-carboxylate
CID 2820821
Fluoro 7-aminothieno[2,3-b]pyrazine-6-carboxylate
CID 141902957
7-(methylamino)-N-propyl-3-(trifluoromethyl)thieno[2,3-b]pyrazine-6-carboxamide
CID 177260606
US20250154162, Example 7
CID 176733448
US20250154162, Example 17
CID 176733457
US20250154162, Example 42
CID 176733482
6-Acetylthienopyrazine
CID 82410051
8-Thia-3,6,11,16-tetrazatetracyclo[7.7.0.02,7.011,15]hexadeca-1(9),2,4,6,15-pentaen-10-one
CID 101854860
7-[(Triphenyl-lambda5-phosphanylidene)amino]thieno[2,3-b]pyrazine-6-carbaldehyde
CID 102035631

Frequently Asked Questions

What is the IUPAC name of 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde?
The IUPAC name of 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde (CID 25228189) is 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde.
What is the SMILES notation for 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde?
The canonical SMILES for 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde is Nc1c(C=O)sc2nccnc12.
What is the InChIKey of 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde?
The InChIKey is DODAPIKZERXETF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5N3OS/c8-5-4(3-11)12-7-6(5)9-1-2-10-7/h1-3H,8H2.
What are the key properties of 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde?
7-aminothieno[2,3-b]pyrazine-6-carbaldehyde has a molecular weight of 179.20 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-aminothieno[2,3-b]pyrazine-6-carbaldehyde is sourced from PubChem (CID 25228189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).