2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile

C13H11ClN4S — CID 71924242

IUPAC2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
SMILESN#Cc1c(N)sc2c1CCN(c1ccncc1Cl)C2
InChIInChI=1S/C13H11ClN4S/c14-10-6-17-3-1-11(10)18-4-2-8-9(5-15)13(16)19-12(8)7-18/h1,3,6H,2,4,7,16H2
InChIKeyFSHFDXURQOCALK-UHFFFAOYSA-N
MW290.78 g/mol
LogP2.81
Rot. Bonds1

About 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile

2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile (PubChem CID 71924242) has the molecular formula C13H11ClN4S and a molecular weight of 290.78 g/mol. Its IUPAC name is 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
PubChem CID71924242
Molecular FormulaC13H11ClN4S
Molecular Weight290.78 g/mol
Exact Mass290.04
IUPAC Name2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
SMILESN#Cc1c(N)sc2c1CCN(c1ccncc1Cl)C2
InChIInChI=1S/C13H11ClN4S/c14-10-6-17-3-1-11(10)18-4-2-8-9(5-15)13(16)19-12(8)7-18/h1,3,6H,2,4,7,16H2
InChIKeyFSHFDXURQOCALK-UHFFFAOYSA-N
XLogP2.81
TPSA65.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.78
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile with MolForge

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Related Compounds

2-amino-6-(2-cyano-4-fluorophenyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 71862576
2-amino-6-(pyridine-4-carbonyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 82098267
2-amino-6-(2-pyridin-3-ylquinazolin-4-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 24528700
2-amino-6-[4-cyano-2-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 133331121
2-amino-6-(4-cyano-2-nitrophenyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 46663248
2-amino-6-(3-chloro-2-methylpyrazolo[1,5-a]quinazolin-5-yl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 24528703
2-amino-6-[[4-(pyridin-3-ylmethoxy)phenyl]methyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 166192685
2-amino-6-[4-cyano-3-(trifluoromethyl)phenyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 133331101
2-amino-6-(3-methyl-5-nitro-2-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 133331136
2-amino-6-tert-butyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 913228
2-(2-amino-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridin-6-yl)-N-methyl-5-nitrobenzamide
CID 133331153
6-acetyl-2-amino-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile
CID 42281672

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile (CID 71924242) is 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile is N#Cc1c(N)sc2c1CCN(c1ccncc1Cl)C2.
What is the InChIKey of 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile?
The InChIKey is FSHFDXURQOCALK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11ClN4S/c14-10-6-17-3-1-11(10)18-4-2-8-9(5-15)13(16)19-12(8)7-18/h1,3,6H,2,4,7,16H2.
What are the key properties of 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile?
2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile has a molecular weight of 290.78 g/mol, XLogP of 2.81, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(3-chloro-4-pyridinyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carbonitrile is sourced from PubChem (CID 71924242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).