3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile

C13H11N5OS — CID 135077711

IUPAC3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile
SMILESN#Cc1cc2c(N)c(C#N)sc2nc1N1CCOCC1
InChIInChI=1S/C13H11N5OS/c14-6-8-5-9-11(16)10(7-15)20-13(9)17-12(8)18-1-3-19-4-2-18/h5H,1-4,16H2
InChIKeyDFMLWVUPWHWGLS-UHFFFAOYSA-N
MW285.33 g/mol
LogP1.46
Rot. Bonds1

About 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile

3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile (PubChem CID 135077711) has the molecular formula C13H11N5OS and a molecular weight of 285.33 g/mol. Its IUPAC name is 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile.

Molecular Properties

Compound Name3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile
PubChem CID135077711
Molecular FormulaC13H11N5OS
Molecular Weight285.33 g/mol
Exact Mass285.07
IUPAC Name3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile
SMILESN#Cc1cc2c(N)c(C#N)sc2nc1N1CCOCC1
InChIInChI=1S/C13H11N5OS/c14-6-8-5-9-11(16)10(7-15)20-13(9)17-12(8)18-1-3-19-4-2-18/h5H,1-4,16H2
InChIKeyDFMLWVUPWHWGLS-UHFFFAOYSA-N
XLogP1.46
TPSA98.96 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.33
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

1-amino-5-morpholin-4-yl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carbonitrile
CID 687349
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CID 10834765
6-amino-5-(4-chlorophenyl)-2-morpholin-4-ylpyridine-3-carbonitrile
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4-amino-2-morpholin-4-yl-1,3-thiazole-5-carbonitrile
CID 21319839
5-(4-methylphenyl)-2-morpholin-4-yl-6-phenylpyridine-3-carbonitrile
CID 59338811
2-amino-6-morpholin-4-yl-5-pyridin-4-ylpyridine-3-carbonitrile
CID 14832727
3-amino-4-methoxy-5-(1,4-oxazepan-4-yl)thiophene-2-carbonitrile
CID 103421786
3-amino-4-methylsulfanyl-5-morpholin-4-ylthiophene-2-carbonitrile
CID 103419029
2-morpholin-4-yl-6-(trifluoromethyl)pyridine-3-carbonitrile
CID 10244167
4,6-dimorpholin-4-ylpyrimidin-5-amine
CID 19137612
5-(6-methyl-4-morpholin-4-ylthieno[2,3-d]pyrimidin-2-yl)pyrimidin-2-amine
CID 59829563
5-amino-2-(3-morpholin-4-ylpyrrolidin-1-yl)pyridine-3-carbonitrile
CID 63168667

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile?
The IUPAC name of 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile (CID 135077711) is 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile.
What is the SMILES notation for 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile?
The canonical SMILES for 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile is N#Cc1cc2c(N)c(C#N)sc2nc1N1CCOCC1.
What is the InChIKey of 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile?
The InChIKey is DFMLWVUPWHWGLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N5OS/c14-6-8-5-9-11(16)10(7-15)20-13(9)17-12(8)18-1-3-19-4-2-18/h5H,1-4,16H2.
What are the key properties of 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile?
3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile has a molecular weight of 285.33 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-morpholin-4-ylthieno[2,3-b]pyridine-2,5-dicarbonitrile is sourced from PubChem (CID 135077711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).