5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine

C12H11N3S — CID 18785794

IUPAC5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine
SMILESNC1=NC(c2cccnc2)Cc2ccsc21
InChIInChI=1S/C12H11N3S/c13-12-11-8(3-5-16-11)6-10(15-12)9-2-1-4-14-7-9/h1-5,7,10H,6H2,(H2,13,15)
InChIKeyDQFBGLAGAZYBJX-UHFFFAOYSA-N
MW229.31 g/mol
LogP2.15
Rot. Bonds1

About 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine

5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine (PubChem CID 18785794) has the molecular formula C12H11N3S and a molecular weight of 229.31 g/mol. Its IUPAC name is 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine.

Molecular Properties

Compound Name5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine
PubChem CID18785794
Molecular FormulaC12H11N3S
Molecular Weight229.31 g/mol
Exact Mass229.07
IUPAC Name5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine
SMILESNC1=NC(c2cccnc2)Cc2ccsc21
InChIInChI=1S/C12H11N3S/c13-12-11-8(3-5-16-11)6-10(15-12)9-2-1-4-14-7-9/h1-5,7,10H,6H2,(H2,13,15)
InChIKeyDQFBGLAGAZYBJX-UHFFFAOYSA-N
XLogP2.15
TPSA51.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.31
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine?
The IUPAC name of 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine (CID 18785794) is 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine.
What is the SMILES notation for 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine?
The canonical SMILES for 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine is NC1=NC(c2cccnc2)Cc2ccsc21.
What is the InChIKey of 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine?
The InChIKey is DQFBGLAGAZYBJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3S/c13-12-11-8(3-5-16-11)6-10(15-12)9-2-1-4-14-7-9/h1-5,7,10H,6H2,(H2,13,15).
What are the key properties of 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine?
5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine has a molecular weight of 229.31 g/mol, XLogP of 2.15, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-pyridin-3-yl-4,5-dihydrothieno[2,3-c]pyridin-7-amine is sourced from PubChem (CID 18785794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).