2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol

C6H10N2O2S — CID 130914021

IUPAC2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol
SMILESCOc1cc(C(N)CO)sn1
InChIInChI=1S/C6H10N2O2S/c1-10-6-2-5(11-8-6)4(7)3-9/h2,4,9H,3,7H2,1H3
InChIKeyPPGBCDJWKYDKOF-UHFFFAOYSA-N
MW174.22 g/mol
LogP0.14
Rot. Bonds3

About 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol

2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol (PubChem CID 130914021) has the molecular formula C6H10N2O2S and a molecular weight of 174.22 g/mol. Its IUPAC name is 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol
PubChem CID130914021
Molecular FormulaC6H10N2O2S
Molecular Weight174.22 g/mol
Exact Mass174.05
IUPAC Name2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol
SMILESCOc1cc(C(N)CO)sn1
InChIInChI=1S/C6H10N2O2S/c1-10-6-2-5(11-8-6)4(7)3-9/h2,4,9H,3,7H2,1H3
InChIKeyPPGBCDJWKYDKOF-UHFFFAOYSA-N
XLogP0.14
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.22
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol?
The IUPAC name of 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol (CID 130914021) is 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol.
What is the SMILES notation for 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol?
The canonical SMILES for 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol is COc1cc(C(N)CO)sn1.
What is the InChIKey of 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol?
The InChIKey is PPGBCDJWKYDKOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O2S/c1-10-6-2-5(11-8-6)4(7)3-9/h2,4,9H,3,7H2,1H3.
What are the key properties of 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol?
2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol has a molecular weight of 174.22 g/mol, XLogP of 0.14, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(3-methoxy-1,2-thiazol-5-yl)ethanol is sourced from PubChem (CID 130914021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).