2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol

C7H12N2OS — CID 131107615

IUPAC2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol
SMILESCN(C)CC(O)c1ccsn1
InChIInChI=1S/C7H12N2OS/c1-9(2)5-7(10)6-3-4-11-8-6/h3-4,7,10H,5H2,1-2H3
InChIKeyPZLWTNQARHFXAX-UHFFFAOYSA-N
MW172.25 g/mol
LogP0.74
Rot. Bonds3

About 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol

2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol (PubChem CID 131107615) has the molecular formula C7H12N2OS and a molecular weight of 172.25 g/mol. Its IUPAC name is 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol.

Molecular Properties

Compound Name2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol
PubChem CID131107615
Molecular FormulaC7H12N2OS
Molecular Weight172.25 g/mol
Exact Mass172.07
IUPAC Name2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol
SMILESCN(C)CC(O)c1ccsn1
InChIInChI=1S/C7H12N2OS/c1-9(2)5-7(10)6-3-4-11-8-6/h3-4,7,10H,5H2,1-2H3
InChIKeyPZLWTNQARHFXAX-UHFFFAOYSA-N
XLogP0.74
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 50.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(Isothiazol-3-yl)ethanol
CID 19017861
3-Azido-1-(1,2-thiazol-3-yl)propan-1-ol
CID 91451221
(1S)-1-(1,2-thiazol-3-yl)ethanol
CID 118480475
1-(1,2-Thiazol-3-yl)butan-1-ol
CID 130642506
1-Methyl-3-(1,2-thiazol-3-yl)pyrrolidin-3-ol
CID 130625922
Pyrrolidin-2-yl(1,2-thiazol-3-yl)methanol
CID 130725448
1-Amino-2-(1,2-thiazol-3-yl)propan-2-ol
CID 130752218
1-Propyl-3-(1,2-thiazol-3-yl)pyrrolidin-3-ol
CID 131101386
1-(1,2-Thiazol-3-yl)propan-1-ol
CID 131150494
1-(1,2-Thiazol-3-yl)but-3-en-1-ol
CID 131160225
2-Amino-3-methyl-1-(1,2-thiazol-3-yl)butan-1-ol
CID 164658481
(2r)-2-Amino-1-(1,2-thiazol-3-yl)butan-1-ol
CID 164661964

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol?
The IUPAC name of 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol (CID 131107615) is 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol.
What is the SMILES notation for 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol?
The canonical SMILES for 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol is CN(C)CC(O)c1ccsn1.
What is the InChIKey of 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol?
The InChIKey is PZLWTNQARHFXAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2OS/c1-9(2)5-7(10)6-3-4-11-8-6/h3-4,7,10H,5H2,1-2H3.
What are the key properties of 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol?
2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol has a molecular weight of 172.25 g/mol, XLogP of 0.74, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-(1,2-thiazol-3-yl)ethanol is sourced from PubChem (CID 131107615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).