4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide

C10H10N4O2S — CID 90436738

IUPAC4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)Nc1ccnc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C10H10N4O2S/c1-4(15)14-5-2-3-13-10-6(5)7(11)8(17-10)9(12)16/h2-3H,11H2,1H3,(H2,12,16)(H,13,14,15)
InChIKeyZONVBCIPSQYGCL-UHFFFAOYSA-N
MW250.28 g/mol
LogP0.94
Rot. Bonds2

About 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide

4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide (PubChem CID 90436738) has the molecular formula C10H10N4O2S and a molecular weight of 250.28 g/mol. Its IUPAC name is 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide
PubChem CID90436738
Molecular FormulaC10H10N4O2S
Molecular Weight250.28 g/mol
Exact Mass250.05
IUPAC Name4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide
SMILESCC(=O)Nc1ccnc2sc(C(N)=O)c(N)c12
InChIInChI=1S/C10H10N4O2S/c1-4(15)14-5-2-3-13-10-6(5)7(11)8(17-10)9(12)16/h2-3H,11H2,1H3,(H2,12,16)(H,13,14,15)
InChIKeyZONVBCIPSQYGCL-UHFFFAOYSA-N
XLogP0.94
TPSA111.10 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3-amino-4-methylthieno[2,3-b]pyridin-2-yl)ethanone
CID 82395893
3-amino-4-[benzyl(methyl)amino]thieno[2,3-b]pyridine-2-carboxamide
CID 10267528
(3-amino-4-anilinothieno[2,3-b]pyridin-2-yl)-phenylmethanone
CID 794547
3-amino-4-piperazin-1-ylthieno[2,3-b]pyridine-2-carboxamide;dihydrochloride
CID 69364402
3-amino-4-(2-chloro-4,5-dimethylphenoxy)thieno[2,3-b]pyridine-2-carboxamide
CID 25004564
3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide
CID 25003888
3-amino-N-(3,4-dimethylphenyl)-4-methylthieno[2,3-b]pyridine-2-carboxamide
CID 171133101
5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide
CID 13295941
3-amino-4-(4-ethylcyclohexyl)oxythieno[2,3-b]pyridine-2-carboxamide
CID 155522878
3-amino-4-[4-(1-amino-3-methyl-1-oxobutan-2-yl)piperazin-1-yl]thieno[2,3-b]pyridine-2-carboxamide
CID 69131930
[3-amino-4-(benzylamino)thieno[2,3-b]pyridin-2-yl]-phenylmethanone
CID 5339110
3-amino-N-(4-amino-2-methyl-4-oxobutan-2-yl)-4-methylthieno[2,3-b]pyridine-2-carboxamide
CID 106098617

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide (CID 90436738) is 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide is CC(=O)Nc1ccnc2sc(C(N)=O)c(N)c12.
What is the InChIKey of 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is ZONVBCIPSQYGCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N4O2S/c1-4(15)14-5-2-3-13-10-6(5)7(11)8(17-10)9(12)16/h2-3H,11H2,1H3,(H2,12,16)(H,13,14,15).
What are the key properties of 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide?
4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 250.28 g/mol, XLogP of 0.94, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 90436738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).