ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile

C16H14N2OS — CID 158277752

IUPACethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile
SMILESCCO.N#Cc1cnc2sc(-c3ccccc3)cc2c1
InChIInChI=1S/C14H8N2S.C2H6O/c15-8-10-6-12-7-13(17-14(12)16-9-10)11-4-2-1-3-5-11;1-2-3/h1-7,9H;3H,2H2,1H3
InChIKeyGJUZSQRVNONXQE-UHFFFAOYSA-N
MW282.37 g/mol
LogP3.83
Rot. Bonds1

About ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile

ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile (PubChem CID 158277752) has the molecular formula C16H14N2OS and a molecular weight of 282.37 g/mol. Its IUPAC name is ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile.

Molecular Properties

Compound Nameethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile
PubChem CID158277752
Molecular FormulaC16H14N2OS
Molecular Weight282.37 g/mol
Exact Mass282.08
IUPAC Nameethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile
SMILESCCO.N#Cc1cnc2sc(-c3ccccc3)cc2c1
InChIInChI=1S/C14H8N2S.C2H6O/c15-8-10-6-12-7-13(17-14(12)16-9-10)11-4-2-1-3-5-11;1-2-3/h1-7,9H;3H,2H2,1H3
InChIKeyGJUZSQRVNONXQE-UHFFFAOYSA-N
XLogP3.83
TPSA56.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.37
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-oxido-2-phenylthieno[2,3-b]pyridin-7-ium-5-carbonitrile
CID 141167613
2-(3,6-diamino-2-cyano-4-methoxyphenyl)thieno[2,3-b]pyridine-5-carbonitrile
CID 144756270
3-thieno[3,2-c]quinolin-2-ylbenzonitrile
CID 71530393
8-hydroxyquinoline-3-carbonitrile
CID 82653167
8-(diethylamino)quinoline-3-carbonitrile
CID 105483149
4-ethylsulfanyl-6-phenylthieno[2,3-d]pyrimidine
CID 7674132
N-(3-cyanophenyl)-2-(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
CID 2488093
4-phenylisoquinoline;quinoline-3-carbonitrile
CID 174493655
3-[5-(3-cyanophenyl)thiophen-2-yl]benzonitrile
CID 11243141
(2S)-2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)amino]butan-1-ol
CID 28849500
4-ethynyl-6-phenylthieno[2,3-d]pyrimidine
CID 138991656
4-(5-methyl-4-phenyl-2-pyridinyl)benzonitrile
CID 168821635

Frequently Asked Questions

What is the IUPAC name of ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile?
The IUPAC name of ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile (CID 158277752) is ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile.
What is the SMILES notation for ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile?
The canonical SMILES for ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile is CCO.N#Cc1cnc2sc(-c3ccccc3)cc2c1.
What is the InChIKey of ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile?
The InChIKey is GJUZSQRVNONXQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8N2S.C2H6O/c15-8-10-6-12-7-13(17-14(12)16-9-10)11-4-2-1-3-5-11;1-2-3/h1-7,9H;3H,2H2,1H3.
What are the key properties of ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile?
ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile has a molecular weight of 282.37 g/mol, XLogP of 3.83, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethanol;2-phenylthieno[2,3-b]pyridine-5-carbonitrile is sourced from PubChem (CID 158277752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).