2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol

C10H9N3OS — CID 2789386

IUPAC2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
SMILESOc1ccccc1C=NNc1nccs1
InChIInChI=1S/C10H9N3OS/c14-9-4-2-1-3-8(9)7-12-13-10-11-5-6-15-10/h1-7,14H,(H,11,13)
InChIKeyAQJOOQHNAFGZEL-UHFFFAOYSA-N
MW219.27 g/mol
LogP2.29
Rot. Bonds3

About 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol

2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol (PubChem CID 2789386) has the molecular formula C10H9N3OS and a molecular weight of 219.27 g/mol. Its IUPAC name is 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol.

Molecular Properties

Compound Name2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
PubChem CID2789386
Molecular FormulaC10H9N3OS
Molecular Weight219.27 g/mol
Exact Mass219.05
IUPAC Name2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
SMILESOc1ccccc1C=NNc1nccs1
InChIInChI=1S/C10H9N3OS/c14-9-4-2-1-3-8(9)7-12-13-10-11-5-6-15-10/h1-7,14H,(H,11,13)
InChIKeyAQJOOQHNAFGZEL-UHFFFAOYSA-N
XLogP2.29
TPSA57.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.27
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-chloro-4-[(Z)-(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 136822378
2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenol
CID 135439965
N-[(2,6-dichlorophenyl)methylideneamino]-1,3-thiazol-2-amine
CID 2790075
N-[(Z)-[2-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-1,3-thiazol-2-amine
CID 42337280
2-methoxy-4-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 2789383
2-[(E)-[(4,5-dimethyl-1,3-thiazol-2-yl)hydrazinylidene]methyl]phenol
CID 135588614
2,6-dibromo-4-[(E)-(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 135878036
bis(2-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]phenol);cadmium
CID 135466896
2-nitro-4-[(E)-(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 135570869
N-[(Z)-(2,5-dimethoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
CID 5349994
2,6-dimethoxy-4-[(E)-(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol
CID 135781520
N-[(4-methoxyphenyl)methylideneamino]-1,3-thiazol-2-amine
CID 74253241

Frequently Asked Questions

What is the IUPAC name of 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol?
The IUPAC name of 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol (CID 2789386) is 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol.
What is the SMILES notation for 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol?
The canonical SMILES for 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol is Oc1ccccc1C=NNc1nccs1.
What is the InChIKey of 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol?
The InChIKey is AQJOOQHNAFGZEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3OS/c14-9-4-2-1-3-8(9)7-12-13-10-11-5-6-15-10/h1-7,14H,(H,11,13).
What are the key properties of 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol?
2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol has a molecular weight of 219.27 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1,3-thiazol-2-ylhydrazinylidene)methyl]phenol is sourced from PubChem (CID 2789386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).