3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol

C15H14N2OS — CID 64830345

IUPAC3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol
SMILESCC(Nc1cccc(O)c1)c1cnc2ccsc2c1
InChIInChI=1S/C15H14N2OS/c1-10(17-12-3-2-4-13(18)8-12)11-7-15-14(16-9-11)5-6-19-15/h2-10,17-18H,1H3
InChIKeyOLKGKOSIZVAQTG-UHFFFAOYSA-N
MW270.36 g/mol
LogP4.18
Rot. Bonds3

About 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol

3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol (PubChem CID 64830345) has the molecular formula C15H14N2OS and a molecular weight of 270.36 g/mol. Its IUPAC name is 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol.

Molecular Properties

Compound Name3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol
PubChem CID64830345
Molecular FormulaC15H14N2OS
Molecular Weight270.36 g/mol
Exact Mass270.08
IUPAC Name3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol
SMILESCC(Nc1cccc(O)c1)c1cnc2ccsc2c1
InChIInChI=1S/C15H14N2OS/c1-10(17-12-3-2-4-13(18)8-12)11-7-15-14(16-9-11)5-6-19-15/h2-10,17-18H,1H3
InChIKeyOLKGKOSIZVAQTG-UHFFFAOYSA-N
XLogP4.18
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.36
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol?
The IUPAC name of 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol (CID 64830345) is 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol.
What is the SMILES notation for 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol?
The canonical SMILES for 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol is CC(Nc1cccc(O)c1)c1cnc2ccsc2c1.
What is the InChIKey of 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol?
The InChIKey is OLKGKOSIZVAQTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2OS/c1-10(17-12-3-2-4-13(18)8-12)11-7-15-14(16-9-11)5-6-19-15/h2-10,17-18H,1H3.
What are the key properties of 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol?
3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol has a molecular weight of 270.36 g/mol, XLogP of 4.18, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-thieno[3,2-b]pyridin-6-ylethylamino)phenol is sourced from PubChem (CID 64830345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).