[5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine

C10H9F2N3OS — CID 79764027

IUPAC[5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COc2ccc(F)cc2F)s1
InChIInChI=1S/C10H9F2N3OS/c11-6-1-2-9(8(12)3-6)16-5-7-4-14-10(15-13)17-7/h1-4H,5,13H2,(H,14,15)
InChIKeyXNQVFZWDYYBTCN-UHFFFAOYSA-N
MW257.26 g/mol
LogP2.29
Rot. Bonds4

About [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine

[5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine (PubChem CID 79764027) has the molecular formula C10H9F2N3OS and a molecular weight of 257.26 g/mol. Its IUPAC name is [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine.

Molecular Properties

Compound Name[5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
PubChem CID79764027
Molecular FormulaC10H9F2N3OS
Molecular Weight257.26 g/mol
Exact Mass257.04
IUPAC Name[5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine
SMILESNNc1ncc(COc2ccc(F)cc2F)s1
InChIInChI=1S/C10H9F2N3OS/c11-6-1-2-9(8(12)3-6)16-5-7-4-14-10(15-13)17-7/h1-4H,5,13H2,(H,14,15)
InChIKeyXNQVFZWDYYBTCN-UHFFFAOYSA-N
XLogP2.29
TPSA60.17 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.26
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-phenoxy-N-[5-(trifluoromethyl)thiazol-2-yl]butanamide
CID 145420152
5-(3-Fluorophenoxy)-1,3-thiazol-2-amine
CID 29928367
N-(5-methylthiazol-2-yl)-3-phenoxy-propanamide
CID 26197793
4-(3,5-difluorophenoxy)-N-(5-methylthiazol-2-yl)butanamide
CID 155547004
4-(2-fluorophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 47336845
4-(3-fluorophenoxy)-N-(5-methyl-1,3-thiazol-2-yl)butanamide
CID 47336960
[2-Fluoro-4-(1,3-thiazol-5-ylmethoxy)phenyl]-dimethylborane
CID 58430075
5-(4-Fluorophenoxy)-2-thiazolamine
CID 87572205
5-[Difluoro(phenoxy)methyl]-1,3-thiazol-2-amine
CID 88664597
[2-Fluoro-4-(1,3-thiazol-5-ylmethoxy)phenyl]borane
CID 88897094
CID 123977867
CID 123977867
5-(2-fluorophenoxy)-2-Thiazolamine
CID 170993204

Frequently Asked Questions

What is the IUPAC name of [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine?
The IUPAC name of [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine (CID 79764027) is [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine.
What is the SMILES notation for [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine?
The canonical SMILES for [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine is NNc1ncc(COc2ccc(F)cc2F)s1.
What is the InChIKey of [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine?
The InChIKey is XNQVFZWDYYBTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3OS/c11-6-1-2-9(8(12)3-6)16-5-7-4-14-10(15-13)17-7/h1-4H,5,13H2,(H,14,15).
What are the key properties of [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine?
[5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine has a molecular weight of 257.26 g/mol, XLogP of 2.29, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[(2,4-difluorophenoxy)methyl]-1,3-thiazol-2-yl]hydrazine is sourced from PubChem (CID 79764027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).