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

C15H19N3OS — CID 43260605

IUPAC6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine
SMILESCCCOc1nc(N2CCc3sccc3C2)ccc1N
InChIInChI=1S/C15H19N3OS/c1-2-8-19-15-12(16)3-4-14(17-15)18-7-5-13-11(10-18)6-9-20-13/h3-4,6,9H,2,5,7-8,10,16H2,1H3
InChIKeyTWRWGSWXBWKNJA-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.08
Rot. Bonds4

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

6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine (PubChem CID 43260605) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine.

Molecular Properties

Compound Name6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine
PubChem CID43260605
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine
SMILESCCCOc1nc(N2CCc3sccc3C2)ccc1N
InChIInChI=1S/C15H19N3OS/c1-2-8-19-15-12(16)3-4-14(17-15)18-7-5-13-11(10-18)6-9-20-13/h3-4,6,9H,2,5,7-8,10,16H2,1H3
InChIKeyTWRWGSWXBWKNJA-UHFFFAOYSA-N
XLogP3.08
TPSA51.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.08
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)-2-propoxypyridin-3-amine?
The IUPAC name of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine (CID 43260605) is 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine.
What is the SMILES notation for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine?
The canonical SMILES for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine is CCCOc1nc(N2CCc3sccc3C2)ccc1N.
What is the InChIKey of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine?
The InChIKey is TWRWGSWXBWKNJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-2-8-19-15-12(16)3-4-14(17-15)18-7-5-13-11(10-18)6-9-20-13/h3-4,6,9H,2,5,7-8,10,16H2,1H3.
What are the key properties of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine?
6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-2-propoxypyridin-3-amine has a molecular weight of 289.40 g/mol, XLogP of 3.08, 4 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)-2-propoxypyridin-3-amine is sourced from PubChem (CID 43260605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).