3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile

C19H12N4S — CID 10664042

IUPAC3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile
SMILESN#Cc1sc2nc(-c3ccccc3)cc(-c3cccnc3)c2c1N
InChIInChI=1S/C19H12N4S/c20-10-16-18(21)17-14(13-7-4-8-22-11-13)9-15(23-19(17)24-16)12-5-2-1-3-6-12/h1-9,11H,21H2
InChIKeyGELOMEDAORUBBJ-UHFFFAOYSA-N
MW328.40 g/mol
LogP4.48
Rot. Bonds2

About 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile

3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile (PubChem CID 10664042) has the molecular formula C19H12N4S and a molecular weight of 328.40 g/mol. Its IUPAC name is 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile.

Molecular Properties

Compound Name3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile
PubChem CID10664042
Molecular FormulaC19H12N4S
Molecular Weight328.40 g/mol
Exact Mass328.08
IUPAC Name3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile
SMILESN#Cc1sc2nc(-c3ccccc3)cc(-c3cccnc3)c2c1N
InChIInChI=1S/C19H12N4S/c20-10-16-18(21)17-14(13-7-4-8-22-11-13)9-15(23-19(17)24-16)12-5-2-1-3-6-12/h1-9,11H,21H2
InChIKeyGELOMEDAORUBBJ-UHFFFAOYSA-N
XLogP4.48
TPSA75.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.40
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-6-methyl-4-phenylthieno[2,3-b]pyridine-2-carbonitrile
CID 749426
(3-amino-4-phenyl-6-pyridin-3-ylthieno[2,3-b]pyridin-2-yl)-(3,5-dimethylpyrazol-1-yl)methanone
CID 46243657
3-(3-amino-2-butylsulfinyl-6-pyridin-3-ylthieno[2,3-b]pyridin-4-yl)benzonitrile
CID 142485898
3-amino-8-phenyl-5-thia-7-azatricyclo[7.3.0.02,6]dodeca-1(9),2(6),3,7-tetraene-4-carbonitrile
CID 1472699
2-phenyl-4-pyridin-3-ylquinoline
CID 175326570
4-(2,6-diphenylpyrimidin-4-yl)-6-[4-[6-(2,6-diphenylpyrimidin-4-yl)-2-pyridin-3-ylpyrimidin-4-yl]phenyl]-2-pyridin-3-ylpyrimidine
CID 167146178
3-amino-4-(3-methylimidazol-4-yl)-6-pyridin-3-ylthieno[2,3-b]pyridine-2-thiol
CID 142485765
4-(3,5-dipyridin-3-ylphenyl)-2,6-diphenylpyridine
CID 58518535
2,4-diphenyl-6-pyridin-3-ylpyridine
CID 3477432
2-amino-6-(2-bromophenyl)-4-pyridin-3-ylpyridine-3-carbonitrile
CID 5117531
[3-amino-6-(4-fluorophenyl)-4-phenylthieno[2,3-b]pyridin-2-yl]-phenylmethanone
CID 5230190
2-amino-6-(4-propylphenyl)-4-pyridin-3-ylpyridine-3-carbonitrile
CID 5088040

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile?
The IUPAC name of 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile (CID 10664042) is 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile.
What is the SMILES notation for 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile?
The canonical SMILES for 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile is N#Cc1sc2nc(-c3ccccc3)cc(-c3cccnc3)c2c1N.
What is the InChIKey of 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile?
The InChIKey is GELOMEDAORUBBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12N4S/c20-10-16-18(21)17-14(13-7-4-8-22-11-13)9-15(23-19(17)24-16)12-5-2-1-3-6-12/h1-9,11H,21H2.
What are the key properties of 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile?
3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile has a molecular weight of 328.40 g/mol, XLogP of 4.48, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-phenyl-4-pyridin-3-ylthieno[2,3-b]pyridine-2-carbonitrile is sourced from PubChem (CID 10664042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).