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

C14H17N3S — CID 80764887

IUPAC6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine
SMILESCCNc1cccc(N2CCc3sccc3C2)n1
InChIInChI=1S/C14H17N3S/c1-2-15-13-4-3-5-14(16-13)17-8-6-12-11(10-17)7-9-18-12/h3-5,7,9H,2,6,8,10H2,1H3,(H,15,16)
InChIKeyZERWRNSPAXXZKO-UHFFFAOYSA-N
MW259.38 g/mol
LogP3.14
Rot. Bonds3

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

6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine (PubChem CID 80764887) has the molecular formula C14H17N3S and a molecular weight of 259.38 g/mol. Its IUPAC name is 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine
PubChem CID80764887
Molecular FormulaC14H17N3S
Molecular Weight259.38 g/mol
Exact Mass259.11
IUPAC Name6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine
SMILESCCNc1cccc(N2CCc3sccc3C2)n1
InChIInChI=1S/C14H17N3S/c1-2-15-13-4-3-5-14(16-13)17-8-6-12-11(10-17)7-9-18-12/h3-5,7,9H,2,6,8,10H2,1H3,(H,15,16)
InChIKeyZERWRNSPAXXZKO-UHFFFAOYSA-N
XLogP3.14
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.38
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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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)-N-ethylpyridin-2-amine?
The IUPAC name of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine (CID 80764887) is 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine?
The canonical SMILES for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine is CCNc1cccc(N2CCc3sccc3C2)n1.
What is the InChIKey of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine?
The InChIKey is ZERWRNSPAXXZKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3S/c1-2-15-13-4-3-5-14(16-13)17-8-6-12-11(10-17)7-9-18-12/h3-5,7,9H,2,6,8,10H2,1H3,(H,15,16).
What are the key properties of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine?
6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine has a molecular weight of 259.38 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-ethylpyridin-2-amine is sourced from PubChem (CID 80764887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).