6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine

C15H20N4S — CID 80814490

IUPAC6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(N2CCc3sccc3C2C)n1
InChIInChI=1S/C15H20N4S/c1-3-6-17-14-9-16-10-15(18-14)19-7-4-13-12(11(19)2)5-8-20-13/h5,8-11H,3-4,6-7H2,1-2H3,(H,17,18)
InChIKeyMIKFFUYLWMKSAX-UHFFFAOYSA-N
MW288.42 g/mol
LogP3.48
Rot. Bonds4

About 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine

6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine (PubChem CID 80814490) has the molecular formula C15H20N4S and a molecular weight of 288.42 g/mol. Its IUPAC name is 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine.

Molecular Properties

Compound Name6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine
PubChem CID80814490
Molecular FormulaC15H20N4S
Molecular Weight288.42 g/mol
Exact Mass288.14
IUPAC Name6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine
SMILESCCCNc1cncc(N2CCc3sccc3C2C)n1
InChIInChI=1S/C15H20N4S/c1-3-6-17-14-9-16-10-15(18-14)19-7-4-13-12(11(19)2)5-8-20-13/h5,8-11H,3-4,6-7H2,1-2H3,(H,17,18)
InChIKeyMIKFFUYLWMKSAX-UHFFFAOYSA-N
XLogP3.48
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.42
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine?
The IUPAC name of 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine (CID 80814490) is 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine.
What is the SMILES notation for 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine?
The canonical SMILES for 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine is CCCNc1cncc(N2CCc3sccc3C2C)n1.
What is the InChIKey of 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine?
The InChIKey is MIKFFUYLWMKSAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4S/c1-3-6-17-14-9-16-10-15(18-14)19-7-4-13-12(11(19)2)5-8-20-13/h5,8-11H,3-4,6-7H2,1-2H3,(H,17,18).
What are the key properties of 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine?
6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine has a molecular weight of 288.42 g/mol, XLogP of 3.48, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methyl-6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-propylpyrazin-2-amine is sourced from PubChem (CID 80814490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).