3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide

C14H10ClN3O2S — CID 25003888

IUPAC3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide
SMILESNC(=O)c1sc2nccc(Oc3ccccc3Cl)c2c1N
InChIInChI=1S/C14H10ClN3O2S/c15-7-3-1-2-4-8(7)20-9-5-6-18-14-10(9)11(16)12(21-14)13(17)19/h1-6H,16H2,(H2,17,19)
InChIKeyBORANBJSUVFHNN-UHFFFAOYSA-N
MW319.77 g/mol
LogP3.42
Rot. Bonds3

About 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide

3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 25003888) has the molecular formula C14H10ClN3O2S and a molecular weight of 319.77 g/mol. Its IUPAC name is 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID25003888
Molecular FormulaC14H10ClN3O2S
Molecular Weight319.77 g/mol
Exact Mass319.02
IUPAC Name3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide
SMILESNC(=O)c1sc2nccc(Oc3ccccc3Cl)c2c1N
InChIInChI=1S/C14H10ClN3O2S/c15-7-3-1-2-4-8(7)20-9-5-6-18-14-10(9)11(16)12(21-14)13(17)19/h1-6H,16H2,(H2,17,19)
InChIKeyBORANBJSUVFHNN-UHFFFAOYSA-N
XLogP3.42
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.77
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-4-(2-chloro-4,5-dimethylphenoxy)thieno[2,3-b]pyridine-2-carboxamide
CID 25004564
3-amino-4-[2-chloro-4-(2-hydroxyethyl)phenoxy]thieno[2,3-b]pyridine-2-carboxamide
CID 25005242
3-amino-4-(4-ethylcyclohexyl)oxythieno[2,3-b]pyridine-2-carboxamide
CID 155522878
4-acetamido-3-aminothieno[2,3-b]pyridine-2-carboxamide
CID 90436738
4-(2-chlorophenoxy)pyridine-2-carboxamide
CID 141149531
3-amino-4-methoxy-N,N-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 90436560
4-(2-chlorophenoxy)pyridin-3-amine
CID 28890150
3-amino-4-[4-(4-fluorophenyl)piperazin-1-yl]thieno[2,3-b]pyridine-2-carboxamide
CID 69364640
3-amino-4-piperazin-1-ylthieno[2,3-b]pyridine-2-carboxamide;dihydrochloride
CID 69364402
5-amino-4-methoxythieno[2,3-d]pyrimidine-6-carboxamide
CID 13295941
3-amino-4-(2-chlorophenoxy)benzamide
CID 43382705
3-amino-5-cyclobutyloxy-4-phenylthieno[2,3-b]pyridine-2-carboxamide
CID 129220605

Frequently Asked Questions

What is the IUPAC name of 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide (CID 25003888) is 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide is NC(=O)c1sc2nccc(Oc3ccccc3Cl)c2c1N.
What is the InChIKey of 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is BORANBJSUVFHNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN3O2S/c15-7-3-1-2-4-8(7)20-9-5-6-18-14-10(9)11(16)12(21-14)13(17)19/h1-6H,16H2,(H2,17,19).
What are the key properties of 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide?
3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 319.77 g/mol, XLogP of 3.42, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-4-(2-chlorophenoxy)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 25003888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).