2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol

C11H12N2OS — CID 14076241

IUPAC2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol
SMILESNCC(O)c1csc(-c2ccccc2)n1
InChIInChI=1S/C11H12N2OS/c12-6-10(14)9-7-15-11(13-9)8-4-2-1-3-5-8/h1-5,7,10,14H,6,12H2
InChIKeyMAGSISQNLPDBEG-UHFFFAOYSA-N
MW220.30 g/mol
LogP1.80
Rot. Bonds3

About 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol

2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol (PubChem CID 14076241) has the molecular formula C11H12N2OS and a molecular weight of 220.30 g/mol. Its IUPAC name is 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol
PubChem CID14076241
Molecular FormulaC11H12N2OS
Molecular Weight220.30 g/mol
Exact Mass220.07
IUPAC Name2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol
SMILESNCC(O)c1csc(-c2ccccc2)n1
InChIInChI=1S/C11H12N2OS/c12-6-10(14)9-7-15-11(13-9)8-4-2-1-3-5-8/h1-5,7,10,14H,6,12H2
InChIKeyMAGSISQNLPDBEG-UHFFFAOYSA-N
XLogP1.80
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.30
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

ethyl (3R)-3-hydroxy-3-(2-phenyl-1,3-thiazol-4-yl)propanoate
CID 102139996
1-(2-phenyl-1,3-thiazol-4-yl)ethanamine
CID 12009827
4-(difluoromethyl)-2-phenyl-1,3-thiazole
CID 91615128
methyl 2-hydroxy-2-(2-phenyl-1,3-thiazol-4-yl)acetate
CID 70818588
2-amino-1-[2-(5-bromothiophen-2-yl)-1,3-thiazol-4-yl]ethanol
CID 116890681
2-amino-1-[2-(2,3,4-trimethylphenyl)-1,3-thiazol-4-yl]ethanol
CID 116890712
2-(2-phenyl-1,3-thiazol-4-yl)butan-1-ol
CID 116891277
2-amino-1-[2-(2,5-difluorophenyl)-1,3-thiazol-4-yl]ethanol
CID 116890686
(1R)-2-amino-1-(2-methyl-1,3-thiazol-4-yl)ethanol
CID 28819519
(2-phenyl-1,3-thiazol-4-yl)methanamine;dihydrochloride
CID 13196628
2-amino-1-[2-(5-bromo-2-fluorophenyl)-1,3-thiazol-4-yl]ethanol
CID 116890698
ethyl (3S)-3-hydroxy-3-[2-(3-methylphenyl)-1,3-thiazol-4-yl]propanoate
CID 102139994

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol?
The IUPAC name of 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol (CID 14076241) is 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol.
What is the SMILES notation for 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol?
The canonical SMILES for 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol is NCC(O)c1csc(-c2ccccc2)n1.
What is the InChIKey of 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol?
The InChIKey is MAGSISQNLPDBEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2OS/c12-6-10(14)9-7-15-11(13-9)8-4-2-1-3-5-8/h1-5,7,10,14H,6,12H2.
What are the key properties of 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol?
2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol has a molecular weight of 220.30 g/mol, XLogP of 1.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-phenyl-1,3-thiazol-4-yl)ethanol is sourced from PubChem (CID 14076241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).