2-amino-1,3-thiazol-4-one;hydrochloride

C3H5ClN2OS — CID 2782348

IUPAC2-amino-1,3-thiazol-4-one;hydrochloride
SMILESCl.NC1=NC(=O)CS1
InChIInChI=1S/C3H4N2OS.ClH/c4-3-5-2(6)1-7-3;/h1H2,(H2,4,5,6);1H
InChIKeyYBDFGIGPQKUYGW-UHFFFAOYSA-N
MW152.61 g/mol
LogP-0.00
Rot. Bonds

About 2-amino-1,3-thiazol-4-one;hydrochloride

2-amino-1,3-thiazol-4-one;hydrochloride (PubChem CID 2782348) has the molecular formula C3H5ClN2OS and a molecular weight of 152.61 g/mol. Its IUPAC name is 2-amino-1,3-thiazol-4-one;hydrochloride.

Molecular Properties

Compound Name2-amino-1,3-thiazol-4-one;hydrochloride
PubChem CID2782348
Molecular FormulaC3H5ClN2OS
Molecular Weight152.61 g/mol
Exact Mass151.98
IUPAC Name2-amino-1,3-thiazol-4-one;hydrochloride
SMILESCl.NC1=NC(=O)CS1
InChIInChI=1S/C3H4N2OS.ClH/c4-3-5-2(6)1-7-3;/h1H2,(H2,4,5,6);1H
InChIKeyYBDFGIGPQKUYGW-UHFFFAOYSA-N
XLogP-0.00
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.61
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1,3-thiazol-4-one;hydrochloride?
The IUPAC name of 2-amino-1,3-thiazol-4-one;hydrochloride (CID 2782348) is 2-amino-1,3-thiazol-4-one;hydrochloride.
What is the SMILES notation for 2-amino-1,3-thiazol-4-one;hydrochloride?
The canonical SMILES for 2-amino-1,3-thiazol-4-one;hydrochloride is Cl.NC1=NC(=O)CS1.
What is the InChIKey of 2-amino-1,3-thiazol-4-one;hydrochloride?
The InChIKey is YBDFGIGPQKUYGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2OS.ClH/c4-3-5-2(6)1-7-3;/h1H2,(H2,4,5,6);1H.
What are the key properties of 2-amino-1,3-thiazol-4-one;hydrochloride?
2-amino-1,3-thiazol-4-one;hydrochloride has a molecular weight of 152.61 g/mol, XLogP of -0.00, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1,3-thiazol-4-one;hydrochloride is sourced from PubChem (CID 2782348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).