[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine

C12H14N4S — CID 66455969

IUPAC[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine
SMILESNCc1cncc(N2CCc3sccc3C2)n1
InChIInChI=1S/C12H14N4S/c13-5-10-6-14-7-12(15-10)16-3-1-11-9(8-16)2-4-17-11/h2,4,6-7H,1,3,5,8,13H2
InChIKeyNPHUAKJPDVQGTF-UHFFFAOYSA-N
MW246.34 g/mol
LogP1.56
Rot. Bonds2

About [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine

[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine (PubChem CID 66455969) has the molecular formula C12H14N4S and a molecular weight of 246.34 g/mol. Its IUPAC name is [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine.

Molecular Properties

Compound Name[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine
PubChem CID66455969
Molecular FormulaC12H14N4S
Molecular Weight246.34 g/mol
Exact Mass246.09
IUPAC Name[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine
SMILESNCc1cncc(N2CCc3sccc3C2)n1
InChIInChI=1S/C12H14N4S/c13-5-10-6-14-7-12(15-10)16-3-1-11-9(8-16)2-4-17-11/h2,4,6-7H,1,3,5,8,13H2
InChIKeyNPHUAKJPDVQGTF-UHFFFAOYSA-N
XLogP1.56
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.34
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine?
The IUPAC name of [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine (CID 66455969) is [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine.
What is the SMILES notation for [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine?
The canonical SMILES for [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine is NCc1cncc(N2CCc3sccc3C2)n1.
What is the InChIKey of [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine?
The InChIKey is NPHUAKJPDVQGTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N4S/c13-5-10-6-14-7-12(15-10)16-3-1-11-9(8-16)2-4-17-11/h2,4,6-7H,1,3,5,8,13H2.
What are the key properties of [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine?
[6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine has a molecular weight of 246.34 g/mol, XLogP of 1.56, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)pyrazin-2-yl]methanamine is sourced from PubChem (CID 66455969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).