2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile

C16H11N3S — CID 10423637

IUPAC2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2)cc(-c2cccs2)nc1N
InChIInChI=1S/C16H11N3S/c17-10-13-12(11-5-2-1-3-6-11)9-14(19-16(13)18)15-7-4-8-20-15/h1-9H,(H2,18,19)
InChIKeyCMOAUWPKTBSUQT-UHFFFAOYSA-N
MW277.35 g/mol
LogP3.93
Rot. Bonds2

About 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile

2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile (PubChem CID 10423637) has the molecular formula C16H11N3S and a molecular weight of 277.35 g/mol. Its IUPAC name is 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile
PubChem CID10423637
Molecular FormulaC16H11N3S
Molecular Weight277.35 g/mol
Exact Mass277.07
IUPAC Name2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile
SMILESN#Cc1c(-c2ccccc2)cc(-c2cccs2)nc1N
InChIInChI=1S/C16H11N3S/c17-10-13-12(11-5-2-1-3-6-11)9-14(19-16(13)18)15-7-4-8-20-15/h1-9H,(H2,18,19)
InChIKeyCMOAUWPKTBSUQT-UHFFFAOYSA-N
XLogP3.93
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile (CID 10423637) is 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile is N#Cc1c(-c2ccccc2)cc(-c2cccs2)nc1N.
What is the InChIKey of 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile?
The InChIKey is CMOAUWPKTBSUQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3S/c17-10-13-12(11-5-2-1-3-6-11)9-14(19-16(13)18)15-7-4-8-20-15/h1-9H,(H2,18,19).
What are the key properties of 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile?
2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile has a molecular weight of 277.35 g/mol, XLogP of 3.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-phenyl-6-thiophen-2-ylpyridine-3-carbonitrile is sourced from PubChem (CID 10423637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).