2-(2-amino-1,3-thiazol-4-yl)phenol

C9H8N2OS — CID 605966

IUPAC2-(2-amino-1,3-thiazol-4-yl)phenol
SMILESNc1nc(-c2ccccc2O)cs1
InChIInChI=1S/C9H8N2OS/c10-9-11-7(5-13-9)6-3-1-2-4-8(6)12/h1-5,12H,(H2,10,11)
InChIKeyQCWXFHZAXVHMHQ-UHFFFAOYSA-N
MW192.24 g/mol
LogP2.10
Rot. Bonds1

About 2-(2-amino-1,3-thiazol-4-yl)phenol

2-(2-amino-1,3-thiazol-4-yl)phenol (PubChem CID 605966) has the molecular formula C9H8N2OS and a molecular weight of 192.24 g/mol. Its IUPAC name is 2-(2-amino-1,3-thiazol-4-yl)phenol.

Molecular Properties

Compound Name2-(2-amino-1,3-thiazol-4-yl)phenol
PubChem CID605966
Molecular FormulaC9H8N2OS
Molecular Weight192.24 g/mol
Exact Mass192.04
IUPAC Name2-(2-amino-1,3-thiazol-4-yl)phenol
SMILESNc1nc(-c2ccccc2O)cs1
InChIInChI=1S/C9H8N2OS/c10-9-11-7(5-13-9)6-3-1-2-4-8(6)12/h1-5,12H,(H2,10,11)
InChIKeyQCWXFHZAXVHMHQ-UHFFFAOYSA-N
XLogP2.10
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.24
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-amino-1,3-thiazol-4-yl)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)phenol?
The IUPAC name of 2-(2-amino-1,3-thiazol-4-yl)phenol (CID 605966) is 2-(2-amino-1,3-thiazol-4-yl)phenol.
What is the SMILES notation for 2-(2-amino-1,3-thiazol-4-yl)phenol?
The canonical SMILES for 2-(2-amino-1,3-thiazol-4-yl)phenol is Nc1nc(-c2ccccc2O)cs1.
What is the InChIKey of 2-(2-amino-1,3-thiazol-4-yl)phenol?
The InChIKey is QCWXFHZAXVHMHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2OS/c10-9-11-7(5-13-9)6-3-1-2-4-8(6)12/h1-5,12H,(H2,10,11).
What are the key properties of 2-(2-amino-1,3-thiazol-4-yl)phenol?
2-(2-amino-1,3-thiazol-4-yl)phenol has a molecular weight of 192.24 g/mol, XLogP of 2.10, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-amino-1,3-thiazol-4-yl)phenol is sourced from PubChem (CID 605966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).