2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol

C17H18N2OS — CID 69493493

IUPAC2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol
SMILESOCCc1cc2c(NCCc3ccccc3)ccnc2s1
InChIInChI=1S/C17H18N2OS/c20-11-8-14-12-15-16(7-10-19-17(15)21-14)18-9-6-13-4-2-1-3-5-13/h1-5,7,10,12,20H,6,8-9,11H2,(H,18,19)
InChIKeyFNBAZDBJPYTMGI-UHFFFAOYSA-N
MW298.41 g/mol
LogP3.49
Rot. Bonds6

About 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol

2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol (PubChem CID 69493493) has the molecular formula C17H18N2OS and a molecular weight of 298.41 g/mol. Its IUPAC name is 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol.

Molecular Properties

Compound Name2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol
PubChem CID69493493
Molecular FormulaC17H18N2OS
Molecular Weight298.41 g/mol
Exact Mass298.11
IUPAC Name2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol
SMILESOCCc1cc2c(NCCc3ccccc3)ccnc2s1
InChIInChI=1S/C17H18N2OS/c20-11-8-14-12-15-16(7-10-19-17(15)21-14)18-9-6-13-4-2-1-3-5-13/h1-5,7,10,12,20H,6,8-9,11H2,(H,18,19)
InChIKeyFNBAZDBJPYTMGI-UHFFFAOYSA-N
XLogP3.49
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[3-Amino-2-butylsulfinyl-6-(1,3-thiazol-2-yl)thieno[2,3-b]pyridin-4-yl]phenyl]ethanol
CID 122635084
1-[2-(4-Benzyl-4-hydroxypiperidin-1-yl)ethyl]-3-thieno[2,3-b]pyridin-4-ylurea
CID 118723012
2-Phenylthieno[2,3-b]pyridin-3-amine
CID 97181610
[4-[(1-Benzylpiperidin-4-yl)amino]-2-(2,2,2-trifluoroethyl)thieno[2,3-b]pyridin-5-yl]methanol
CID 90453308
5-(4-Methylphenyl)-13-(2,2,2-trifluoroethylamino)-8-thia-5,10-diazatricyclo[7.4.0.02,7]trideca-1(13),2(7),3,9,11-pentaen-6-ol
CID 143416702
methyl N-[2,4-difluoro-3-[[2-(1-methyl-8-oxa-1-azaspiro[4.5]dec-3-en-4-yl)thieno[2,3-b]pyridin-4-yl]amino]phenyl]methanimidothioate
CID 154953225
2-(2,4-Difluorophenyl)-1-[(5-pyridin-4-ylthiophen-3-yl)amino]ethanol
CID 163497926
4-(Phenylamino)thieno[2,3-b]pyridine
CID 91244994
1-(3-Aminothieno[2,3-b]pyrid-2-yl)-1-ethanol
CID 129794461
N-phenyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-b]pyridin-4-amine
CID 134846477
2-(Thieno[3,2-b]pyridin-6-ylmethylamino)-2-(3,4,5-trifluorophenyl)ethanol
CID 109396424
3-[(7-Fluoroquinolin-4-yl)amino]-3-thiophen-2-ylpropan-1-ol
CID 132479673

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol?
The IUPAC name of 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol (CID 69493493) is 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol.
What is the SMILES notation for 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol?
The canonical SMILES for 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol is OCCc1cc2c(NCCc3ccccc3)ccnc2s1.
What is the InChIKey of 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol?
The InChIKey is FNBAZDBJPYTMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2OS/c20-11-8-14-12-15-16(7-10-19-17(15)21-14)18-9-6-13-4-2-1-3-5-13/h1-5,7,10,12,20H,6,8-9,11H2,(H,18,19).
What are the key properties of 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol?
2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol has a molecular weight of 298.41 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-phenylethylamino)thieno[2,3-b]pyridin-2-yl]ethanol is sourced from PubChem (CID 69493493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).