2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol

C11H12N2O2S — CID 28857958

IUPAC2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol
SMILESNc1nc(-c2ccccc2OCCO)cs1
InChIInChI=1S/C11H12N2O2S/c12-11-13-9(7-16-11)8-3-1-2-4-10(8)15-6-5-14/h1-4,7,14H,5-6H2,(H2,12,13)
InChIKeyFBPGCYSQULKDSI-UHFFFAOYSA-N
MW236.30 g/mol
LogP1.76
Rot. Bonds4

About 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol

2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol (PubChem CID 28857958) has the molecular formula C11H12N2O2S and a molecular weight of 236.30 g/mol. Its IUPAC name is 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol.

Molecular Properties

Compound Name2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol
PubChem CID28857958
Molecular FormulaC11H12N2O2S
Molecular Weight236.30 g/mol
Exact Mass236.06
IUPAC Name2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol
SMILESNc1nc(-c2ccccc2OCCO)cs1
InChIInChI=1S/C11H12N2O2S/c12-11-13-9(7-16-11)8-3-1-2-4-10(8)15-6-5-14/h1-4,7,14H,5-6H2,(H2,12,13)
InChIKeyFBPGCYSQULKDSI-UHFFFAOYSA-N
XLogP1.76
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.30
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-[2-(3-aminopropoxy)phenyl]-1,3-thiazol-2-amine
CID 28857982
4-[2-(2-phenoxyethoxy)phenyl]-1,3-thiazol-2-amine
CID 28857922
2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]-1-pyrrolidin-1-ylethanone
CID 28857676
2-(2-pyridin-2-ylphenoxy)ethanol
CID 170698166
ethyl 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]acetate;hydrobromide
CID 56832420
4-(2-aminophenyl)-1,3-thiazol-2-amine
CID 28865398
[2-(2-amino-1,3-thiazol-4-yl)phenyl]methanol
CID 105459084
cyclopentyl 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]acetate
CID 28857824
2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-benzylacetamide
CID 28857665
5-[2-[2-(trifluoromethyl)-1,3-thiazol-4-yl]phenoxy]pentan-1-ol
CID 160850769
2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]-N-(2-methylphenyl)acetamide
CID 28857578
N-methyl-4-[2-[2-[2-[2-(methylamino)-1,3-thiazol-4-yl]phenoxy]ethoxy]phenyl]-1,3-thiazol-2-amine
CID 139228012

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol?
The IUPAC name of 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol (CID 28857958) is 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol.
What is the SMILES notation for 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol?
The canonical SMILES for 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol is Nc1nc(-c2ccccc2OCCO)cs1.
What is the InChIKey of 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol?
The InChIKey is FBPGCYSQULKDSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2S/c12-11-13-9(7-16-11)8-3-1-2-4-10(8)15-6-5-14/h1-4,7,14H,5-6H2,(H2,12,13).
What are the key properties of 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol?
2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol has a molecular weight of 236.30 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-amino-1,3-thiazol-4-yl)phenoxy]ethanol is sourced from PubChem (CID 28857958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).