(1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol

C5H8N2OS — CID 83004028

IUPAC(1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol
SMILESNC[C@H](O)c1nccs1
InChIInChI=1S/C5H8N2OS/c6-3-4(8)5-7-1-2-9-5/h1-2,4,8H,3,6H2/t4-/m0/s1
InChIKeyYITMIMFEDYPHGH-BYPYZUCNSA-N
MW144.20 g/mol
LogP0.14
Rot. Bonds2

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

(1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol (PubChem CID 83004028) has the molecular formula C5H8N2OS and a molecular weight of 144.20 g/mol. Its IUPAC name is (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol.

Molecular Properties

Compound Name(1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol
PubChem CID83004028
Molecular FormulaC5H8N2OS
Molecular Weight144.20 g/mol
Exact Mass144.04
IUPAC Name(1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol
SMILESNC[C@H](O)c1nccs1
InChIInChI=1S/C5H8N2OS/c6-3-4(8)5-7-1-2-9-5/h1-2,4,8H,3,6H2/t4-/m0/s1
InChIKeyYITMIMFEDYPHGH-BYPYZUCNSA-N
XLogP0.14
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.20
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-2-(1,3-thiazol-2-yl)propan-1-ol
CID 63216153
3-hydroxy-3-(1,3-thiazol-2-yl)propanenitrile
CID 119082530
4-[2-amino-1-(1,3-thiazol-2-yl)ethyl]phenol
CID 115032136
(1S)-2-phenyl-1-(1,3-thiazol-2-yl)ethanol
CID 154527868
1-(1,3-thiazol-2-yl)octan-1-ol
CID 10943825
(2S)-2-amino-2-(1,3-thiazol-2-yl)ethanol
CID 96733513
1-(1,3-thiazol-2-yl)-2-thiophen-3-ylethanol
CID 67759146
(2R)-2-amino-2-(1,3-thiazol-2-yl)acetic acid
CID 22823511
(1R)-4-phenyl-1-(1,3-thiazol-2-yl)butan-1-ol
CID 174457838
4-[3-amino-1-(1,3-thiazol-2-yl)propyl]phenol
CID 115040294
(1R)-3-cyclohexyl-1-(1,3-thiazol-2-yl)propan-1-ol
CID 22843366
1-(1,3-thiazol-2-yl)butane-1,2,4-triol
CID 171871689

Frequently Asked Questions

What is the IUPAC name of (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol?
The IUPAC name of (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol (CID 83004028) is (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol.
What is the SMILES notation for (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol?
The canonical SMILES for (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol is NC[C@H](O)c1nccs1.
What is the InChIKey of (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol?
The InChIKey is YITMIMFEDYPHGH-BYPYZUCNSA-N. The full InChI is InChI=1S/C5H8N2OS/c6-3-4(8)5-7-1-2-9-5/h1-2,4,8H,3,6H2/t4-/m0/s1.
What are the key properties of (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol?
(1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol has a molecular weight of 144.20 g/mol, XLogP of 0.14, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-amino-1-(1,3-thiazol-2-yl)ethanol is sourced from PubChem (CID 83004028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).