2-(1,3-thiazol-4-ylmethylideneamino)phenol

C10H8N2OS — CID 131236355

IUPAC2-(1,3-thiazol-4-ylmethylideneamino)phenol
SMILESOc1ccccc1/N=C/c1cscn1
InChIInChI=1S/C10H8N2OS/c13-10-4-2-1-3-9(10)11-5-8-6-14-7-12-8/h1-7,13H/b11-5+
InChIKeyPZHMDYKFTHDLIM-VZUCSPMQSA-N
MW204.25 g/mol
LogP2.60
Rot. Bonds2

About 2-(1,3-thiazol-4-ylmethylideneamino)phenol

2-(1,3-thiazol-4-ylmethylideneamino)phenol (PubChem CID 131236355) has the molecular formula C10H8N2OS and a molecular weight of 204.25 g/mol. Its IUPAC name is 2-(1,3-thiazol-4-ylmethylideneamino)phenol.

Molecular Properties

Compound Name2-(1,3-thiazol-4-ylmethylideneamino)phenol
PubChem CID131236355
Molecular FormulaC10H8N2OS
Molecular Weight204.25 g/mol
Exact Mass204.04
IUPAC Name2-(1,3-thiazol-4-ylmethylideneamino)phenol
SMILESOc1ccccc1/N=C/c1cscn1
InChIInChI=1S/C10H8N2OS/c13-10-4-2-1-3-9(10)11-5-8-6-14-7-12-8/h1-7,13H/b11-5+
InChIKeyPZHMDYKFTHDLIM-VZUCSPMQSA-N
XLogP2.60
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.25
LogP ≤ 52.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_phenol_A(3)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2-(quinoxalin-2-ylmethylideneamino)phenol
CID 135531091
copper 2-[(2-hydroxyphenyl)iminomethyl]phenol
CID 135534570
zinc 2-[(2-hydroxyphenyl)iminomethyl]phenol
CID 135534569
2-(1H-imidazol-2-ylmethylideneamino)phenol;methanol
CID 139182795
2-[(2,6-dichlorophenyl)methylideneamino]phenol
CID 677290
2-[(2-fluorophenyl)methylideneamino]phenol
CID 677307
2-[(2-methylphenyl)methylideneamino]phenol
CID 11009223
2-[(4-phenylphenyl)methylideneamino]phenol
CID 59227908
N-(1,3-thiazol-4-ylmethylideneamino)acetamide
CID 130738224
2-[[2-[[2-[(2-hydroxyphenyl)iminomethyl]phenyl]diselanyl]phenyl]methylideneamino]phenol
CID 102341808
2-[(4-phenylmethoxyphenyl)methylideneamino]phenol
CID 561470
4-[[2-[(4-hydroxyphenyl)methylideneamino]phenyl]iminomethyl]phenol
CID 135633900

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-thiazol-4-ylmethylideneamino)phenol?
The IUPAC name of 2-(1,3-thiazol-4-ylmethylideneamino)phenol (CID 131236355) is 2-(1,3-thiazol-4-ylmethylideneamino)phenol.
What is the SMILES notation for 2-(1,3-thiazol-4-ylmethylideneamino)phenol?
The canonical SMILES for 2-(1,3-thiazol-4-ylmethylideneamino)phenol is Oc1ccccc1/N=C/c1cscn1.
What is the InChIKey of 2-(1,3-thiazol-4-ylmethylideneamino)phenol?
The InChIKey is PZHMDYKFTHDLIM-VZUCSPMQSA-N. The full InChI is InChI=1S/C10H8N2OS/c13-10-4-2-1-3-9(10)11-5-8-6-14-7-12-8/h1-7,13H/b11-5+.
What are the key properties of 2-(1,3-thiazol-4-ylmethylideneamino)phenol?
2-(1,3-thiazol-4-ylmethylideneamino)phenol has a molecular weight of 204.25 g/mol, XLogP of 2.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-thiazol-4-ylmethylideneamino)phenol is sourced from PubChem (CID 131236355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).