2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane

C11H13N3S — CID 169181365

IUPAC2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane
SMILESCC.Cc1ccnc2sc(N)c(C#N)c12
InChIInChI=1S/C9H7N3S.C2H6/c1-5-2-3-12-9-7(5)6(4-10)8(11)13-9;1-2/h2-3H,11H2,1H3;1-2H3
InChIKeyRJMYDCNKZZODSK-UHFFFAOYSA-N
MW219.31 g/mol
LogP3.08
Rot. Bonds

About 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane

2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane (PubChem CID 169181365) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane.

Molecular Properties

Compound Name2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane
PubChem CID169181365
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC Name2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane
SMILESCC.Cc1ccnc2sc(N)c(C#N)c12
InChIInChI=1S/C9H7N3S.C2H6/c1-5-2-3-12-9-7(5)6(4-10)8(11)13-9;1-2/h2-3H,11H2,1H3;1-2H3
InChIKeyRJMYDCNKZZODSK-UHFFFAOYSA-N
XLogP3.08
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane?
The IUPAC name of 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane (CID 169181365) is 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane.
What is the SMILES notation for 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane?
The canonical SMILES for 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane is CC.Cc1ccnc2sc(N)c(C#N)c12.
What is the InChIKey of 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane?
The InChIKey is RJMYDCNKZZODSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7N3S.C2H6/c1-5-2-3-12-9-7(5)6(4-10)8(11)13-9;1-2/h2-3H,11H2,1H3;1-2H3.
What are the key properties of 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane?
2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane has a molecular weight of 219.31 g/mol, XLogP of 3.08, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methylthieno[2,3-b]pyridine-3-carbonitrile;ethane is sourced from PubChem (CID 169181365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).