3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid

C13H9N3O2S — CID 14113060

IUPAC3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid
SMILESNc1c(C(=O)O)sc2nc(-c3cccnc3)ccc12
InChIInChI=1S/C13H9N3O2S/c14-10-8-3-4-9(7-2-1-5-15-6-7)16-12(8)19-11(10)13(17)18/h1-6H,14H2,(H,17,18)
InChIKeySRSCSSIGRQPQRV-UHFFFAOYSA-N
MW271.30 g/mol
LogP2.64
Rot. Bonds2

About 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid

3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid (PubChem CID 14113060) has the molecular formula C13H9N3O2S and a molecular weight of 271.30 g/mol. Its IUPAC name is 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid
PubChem CID14113060
Molecular FormulaC13H9N3O2S
Molecular Weight271.30 g/mol
Exact Mass271.04
IUPAC Name3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid
SMILESNc1c(C(=O)O)sc2nc(-c3cccnc3)ccc12
InChIInChI=1S/C13H9N3O2S/c14-10-8-3-4-9(7-2-1-5-15-6-7)16-12(8)19-11(10)13(17)18/h1-6H,14H2,(H,17,18)
InChIKeySRSCSSIGRQPQRV-UHFFFAOYSA-N
XLogP2.64
TPSA89.10 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.30
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylate
CID 753891
benzyl 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylate
CID 1009034
3-amino-6-phenyl-N-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide
CID 23772142
(3-amino-6-pyridin-3-ylthieno[2,3-b]pyridin-2-yl)-(3-nitrophenyl)methanone
CID 5117411
3-amino-N,N,6-triphenylthieno[2,3-b]pyridine-2-carboxamide
CID 23999219
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-piperidin-1-ylmethanone
CID 23943390
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(4-methylphenyl)methanone
CID 765624
(3-amino-6-phenylthieno[2,3-b]pyridin-2-yl)-(2,3-dihydroindol-1-yl)methanone
CID 23999221
(3-amino-6-pyridin-3-ylthieno[2,3-b]pyridin-2-yl)-(3,4-dihydro-2H-quinolin-1-yl)methanol
CID 138710960
3-amino-N-cyclohexa-1,3-dien-1-yl-N-[(Z)-4-hydroxybut-2-enyl]-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxamide
CID 138710969
3-amino-4,6-diphenylthieno[2,3-b]pyridine-2-carboxylic acid
CID 683021
4-phenyl-2-pyridin-3-yl-1,3-thiazole-5-carboxylic acid
CID 73012806

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid?
The IUPAC name of 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid (CID 14113060) is 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid.
What is the SMILES notation for 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid?
The canonical SMILES for 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid is Nc1c(C(=O)O)sc2nc(-c3cccnc3)ccc12.
What is the InChIKey of 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid?
The InChIKey is SRSCSSIGRQPQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O2S/c14-10-8-3-4-9(7-2-1-5-15-6-7)16-12(8)19-11(10)13(17)18/h1-6H,14H2,(H,17,18).
What are the key properties of 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid?
3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid has a molecular weight of 271.30 g/mol, XLogP of 2.64, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-pyridin-3-ylthieno[2,3-b]pyridine-2-carboxylic acid is sourced from PubChem (CID 14113060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).