2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile

C11H9N3S — CID 62197120

IUPAC2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile
SMILESCNc1nc(-c2cccs2)ccc1C#N
InChIInChI=1S/C11H9N3S/c1-13-11-8(7-12)4-5-9(14-11)10-3-2-6-15-10/h2-6H,1H3,(H,13,14)
InChIKeyJTJHGWSVQUWYTB-UHFFFAOYSA-N
MW215.28 g/mol
LogP2.72
Rot. Bonds2

About 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile

2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile (PubChem CID 62197120) has the molecular formula C11H9N3S and a molecular weight of 215.28 g/mol. Its IUPAC name is 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile
PubChem CID62197120
Molecular FormulaC11H9N3S
Molecular Weight215.28 g/mol
Exact Mass215.05
IUPAC Name2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile
SMILESCNc1nc(-c2cccs2)ccc1C#N
InChIInChI=1S/C11H9N3S/c1-13-11-8(7-12)4-5-9(14-11)10-3-2-6-15-10/h2-6H,1H3,(H,13,14)
InChIKeyJTJHGWSVQUWYTB-UHFFFAOYSA-N
XLogP2.72
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.28
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile?
The IUPAC name of 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile (CID 62197120) is 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile.
What is the SMILES notation for 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile?
The canonical SMILES for 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile is CNc1nc(-c2cccs2)ccc1C#N.
What is the InChIKey of 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile?
The InChIKey is JTJHGWSVQUWYTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3S/c1-13-11-8(7-12)4-5-9(14-11)10-3-2-6-15-10/h2-6H,1H3,(H,13,14).
What are the key properties of 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile?
2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile has a molecular weight of 215.28 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-6-thiophen-2-ylpyridine-3-carbonitrile is sourced from PubChem (CID 62197120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).