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

C17H18N2OS — CID 64830222

IUPAC1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol
SMILESCC(NCC(O)c1ccccc1)c1cnc2ccsc2c1
InChIInChI=1S/C17H18N2OS/c1-12(14-9-17-15(19-10-14)7-8-21-17)18-11-16(20)13-5-3-2-4-6-13/h2-10,12,16,18,20H,11H2,1H3
InChIKeyWUWIHGIXEQLJOI-UHFFFAOYSA-N
MW298.41 g/mol
LogP3.68
Rot. Bonds5

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

1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol (PubChem CID 64830222) has the molecular formula C17H18N2OS and a molecular weight of 298.41 g/mol. Its IUPAC name is 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol.

Molecular Properties

Compound Name1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol
PubChem CID64830222
Molecular FormulaC17H18N2OS
Molecular Weight298.41 g/mol
Exact Mass298.11
IUPAC Name1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol
SMILESCC(NCC(O)c1ccccc1)c1cnc2ccsc2c1
InChIInChI=1S/C17H18N2OS/c1-12(14-9-17-15(19-10-14)7-8-21-17)18-11-16(20)13-5-3-2-4-6-13/h2-10,12,16,18,20H,11H2,1H3
InChIKeyWUWIHGIXEQLJOI-UHFFFAOYSA-N
XLogP3.68
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol with MolForge

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Related Compounds

2-(1-thieno[3,2-b]pyridin-6-ylethylamino)acetic acid
CID 64828783
N-(2-phenylsulfanylethyl)-1-thieno[3,2-b]pyridin-6-ylethanamine
CID 64829637
N'-(1-thieno[3,2-b]pyridin-6-ylethyl)ethane-1,2-diamine
CID 64830566
2-bromo-N-(1-thieno[3,2-b]pyridin-6-ylethyl)prop-2-en-1-amine
CID 115717289
N-[2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethyl]acetamide
CID 64829172
N'-(1-thieno[3,2-b]pyridin-6-ylethyl)propane-1,3-diamine
CID 64830568
2,2-dimethyl-3-(1-thieno[3,2-b]pyridin-6-ylethylamino)propan-1-ol
CID 115359066
1-thieno[3,2-b]pyridin-6-ylethanol
CID 64830910
2-methyl-3-pyrrolidin-1-yl-N-(1-thieno[3,2-b]pyridin-6-ylethyl)propan-1-amine
CID 64830975
N'-(1-thieno[3,2-b]pyridin-6-ylethyl)butane-1,4-diamine
CID 64830758
1-phenyl-2-(1-phenylethylamino)ethanol
CID 4665183
(1S)-1-phenyl-2-(1-phenylethylamino)ethanol
CID 70464051

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol?
The IUPAC name of 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol (CID 64830222) is 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol.
What is the SMILES notation for 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol?
The canonical SMILES for 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol is CC(NCC(O)c1ccccc1)c1cnc2ccsc2c1.
What is the InChIKey of 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol?
The InChIKey is WUWIHGIXEQLJOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2OS/c1-12(14-9-17-15(19-10-14)7-8-21-17)18-11-16(20)13-5-3-2-4-6-13/h2-10,12,16,18,20H,11H2,1H3.
What are the key properties of 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol?
1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol has a molecular weight of 298.41 g/mol, XLogP of 3.68, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(1-thieno[3,2-b]pyridin-6-ylethylamino)ethanol is sourced from PubChem (CID 64830222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).