N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide

C20H12F2N2OS — CID 58026319

IUPACN,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1sc2ncccc2c1-c1ccc(F)cc1
InChIInChI=1S/C20H12F2N2OS/c21-13-5-3-12(4-6-13)17-16-2-1-11-23-20(16)26-18(17)19(25)24-15-9-7-14(22)8-10-15/h1-11H,(H,24,25)
InChIKeyKAXFXLDUIDCUGM-UHFFFAOYSA-N
MW366.39 g/mol
LogP5.49
Rot. Bonds3

About N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide

N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide (PubChem CID 58026319) has the molecular formula C20H12F2N2OS and a molecular weight of 366.39 g/mol. Its IUPAC name is N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide.

Molecular Properties

Compound NameN,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide
PubChem CID58026319
Molecular FormulaC20H12F2N2OS
Molecular Weight366.39 g/mol
Exact Mass366.06
IUPAC NameN,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1)c1sc2ncccc2c1-c1ccc(F)cc1
InChIInChI=1S/C20H12F2N2OS/c21-13-5-3-12(4-6-13)17-16-2-1-11-23-20(16)26-18(17)19(25)24-15-9-7-14(22)8-10-15/h1-11H,(H,24,25)
InChIKeyKAXFXLDUIDCUGM-UHFFFAOYSA-N
XLogP5.49
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500366.39
LogP ≤ 55.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-amino-N-(4-fluorophenyl)-4,6-dimethylthieno[2,3-b]pyridine-2-carboxamide
CID 712295
3-Amino-4-anilinothieno[2,3-b]pyridine-2-carboxamide
CID 750059
3-Amino-N-(2-fluorophenyl)-6,7,8,9-tetrahydro-5H-cyclohepta[B]thieno[3,2-E]pyridine-2-carboxamide
CID 1023422
4-[(4-Phenylphenyl)amino]thieno[2,3-c]pyridine-2-carboxamide
CID 25218748
5-(4-Bromophenyl)-13-(methylamino)-8-thia-5,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-one
CID 15953801
3-Amino-4-pyridin-3-yl-6,7-dihydro-5H-1-thia-8-aza-s-indacene-2-carboxylic acid amide
CID 706211
3-Amino-6-(pyridin-3-yl)thieno[2,3-b]pyridine-2-carboxamide
CID 766178
3-Amino-N,N-diethyl-6-PH-4-(trifluoromethyl)thieno(2,3-B)pyridine-2-carboxamide
CID 1157648
4-(3-Phenylphenyl)thieno[2,3-c]pyridine-2-carboxamide
CID 25218751
3-amino-6-(4-fluorophenyl)-N-[(4-methylphenyl)methyl]thieno[2,3-b]pyridine-2-carboxamide
CID 1004132
3-amino-N-(2-fluorophenyl)-6-(3-pyridinyl)-2-thieno[2,3-b]pyridinecarboxamide
CID 1962617
2,6-difluoro-N-(2-(2-(pyridin-3-yl)thiazol-4-yl)ethyl)benzamide
CID 7119150

Frequently Asked Questions

What is the IUPAC name of N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide?
The IUPAC name of N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide (CID 58026319) is N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide.
What is the SMILES notation for N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide?
The canonical SMILES for N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide is O=C(Nc1ccc(F)cc1)c1sc2ncccc2c1-c1ccc(F)cc1.
What is the InChIKey of N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide?
The InChIKey is KAXFXLDUIDCUGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12F2N2OS/c21-13-5-3-12(4-6-13)17-16-2-1-11-23-20(16)26-18(17)19(25)24-15-9-7-14(22)8-10-15/h1-11H,(H,24,25).
What are the key properties of N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide?
N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide has a molecular weight of 366.39 g/mol, XLogP of 5.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,3-bis(4-fluorophenyl)thieno[2,3-b]pyridine-2-carboxamide is sourced from PubChem (CID 58026319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).