thieno[2,3-b]pyridine-2-carboximidamide

C8H7N3S — CID 5439

IUPACthieno[2,3-b]pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cc2cccnc2s1
InChIInChI=1S/C8H7N3S/c9-7(10)6-4-5-2-1-3-11-8(5)12-6/h1-4H,(H3,9,10)
InChIKeyGZEJMYFXZMUAEC-UHFFFAOYSA-N
MW177.23 g/mol
LogP1.58
Rot. Bonds1

About thieno[2,3-b]pyridine-2-carboximidamide

thieno[2,3-b]pyridine-2-carboximidamide (PubChem CID 5439) has the molecular formula C8H7N3S and a molecular weight of 177.23 g/mol. Its IUPAC name is thieno[2,3-b]pyridine-2-carboximidamide.

Molecular Properties

Compound Namethieno[2,3-b]pyridine-2-carboximidamide
PubChem CID5439
Molecular FormulaC8H7N3S
Molecular Weight177.23 g/mol
Exact Mass177.04
IUPAC Namethieno[2,3-b]pyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cc2cccnc2s1
InChIInChI=1S/C8H7N3S/c9-7(10)6-4-5-2-1-3-11-8(5)12-6/h1-4H,(H3,9,10)
InChIKeyGZEJMYFXZMUAEC-UHFFFAOYSA-N
XLogP1.58
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.23
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

Thieno(2,3-c)pyridine
CID 9224
3-(3-Thienyl)pyridine
CID 595254
3-(2-Thienyl)pyridine
CID 595145
Thieno(2,3-b)pyridine
CID 289928
(5-Pyrid-3-ylthien-2-YL)methylamine
CID 11206290
N-Methyl-(5-pyrid-3-ylthien-2-yl)methylamine
CID 11321674
Thieno(3,2-c)pyridine
CID 67500
Thieno[2,3-b]pyridin-3-amine
CID 289923
Methyl-(5-pyridin-3-yl-thiophen-2-yl)-amine
CID 44388719
Dimethyl({[5-(pyridin-3-yl)thiophen-2-yl]methyl})amine
CID 11310529
Thieno[2,3-c][2,7]naphthyridine
CID 901691
n-Methyl-1-(thieno[2,3-b]pyridin-2-yl)methanamine
CID 7537465

Frequently Asked Questions

What is the IUPAC name of thieno[2,3-b]pyridine-2-carboximidamide?
The IUPAC name of thieno[2,3-b]pyridine-2-carboximidamide (CID 5439) is thieno[2,3-b]pyridine-2-carboximidamide.
What is the SMILES notation for thieno[2,3-b]pyridine-2-carboximidamide?
The canonical SMILES for thieno[2,3-b]pyridine-2-carboximidamide is [H]/N=C(\N)c1cc2cccnc2s1.
What is the InChIKey of thieno[2,3-b]pyridine-2-carboximidamide?
The InChIKey is GZEJMYFXZMUAEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3S/c9-7(10)6-4-5-2-1-3-11-8(5)12-6/h1-4H,(H3,9,10).
What are the key properties of thieno[2,3-b]pyridine-2-carboximidamide?
thieno[2,3-b]pyridine-2-carboximidamide has a molecular weight of 177.23 g/mol, XLogP of 1.58, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for thieno[2,3-b]pyridine-2-carboximidamide is sourced from PubChem (CID 5439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).