[(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine

C14H19FN4S — CID 105302694

IUPAC[(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
SMILESCc1cc(C(NN)c2snnc2C(C)(C)C)ccc1F
InChIInChI=1S/C14H19FN4S/c1-8-7-9(5-6-10(8)15)11(17-16)12-13(14(2,3)4)18-19-20-12/h5-7,11,17H,16H2,1-4H3
InChIKeyIOWQXDBMOZOQKX-UHFFFAOYSA-N
MW294.40 g/mol
LogP2.84
Rot. Bonds3

About [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine

[(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine (PubChem CID 105302694) has the molecular formula C14H19FN4S and a molecular weight of 294.40 g/mol. Its IUPAC name is [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
PubChem CID105302694
Molecular FormulaC14H19FN4S
Molecular Weight294.40 g/mol
Exact Mass294.13
IUPAC Name[(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
SMILESCc1cc(C(NN)c2snnc2C(C)(C)C)ccc1F
InChIInChI=1S/C14H19FN4S/c1-8-7-9(5-6-10(8)15)11(17-16)12-13(14(2,3)4)18-19-20-12/h5-7,11,17H,16H2,1-4H3
InChIKeyIOWQXDBMOZOQKX-UHFFFAOYSA-N
XLogP2.84
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 52.84
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'}

Analyze [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine with MolForge

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

Launch Full Analysis

Related Compounds

[(4-tert-butylthiadiazol-5-yl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105305034
1-(4-tert-butylthiadiazol-5-yl)-1-(3-fluoro-4-methylphenyl)-N-methylmethanamine
CID 107130322
N-[(4-tert-butylthiadiazol-5-yl)-(3-fluoro-4-methylphenyl)methyl]ethanamine
CID 107130488
[(4-tert-butylthiadiazol-5-yl)-(4-chloro-3-methoxyphenyl)methyl]hydrazine
CID 105320871
1-(4-tert-butylthiadiazol-5-yl)-1-(2,6-difluoro-3-methylphenyl)-N-methylmethanamine
CID 105175903
[(4-fluoro-3-methylphenyl)-(thiadiazol-5-yl)methyl]hydrazine
CID 105302551
1-(4-tert-butylthiadiazol-5-yl)ethylhydrazine
CID 105282656
1-(4-tert-butylthiadiazol-5-yl)-1-(3-chloro-4-methylphenyl)-N-methylmethanamine
CID 107561888
[(3-fluoro-4-methylphenyl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 105201447
[(4-chlorophenyl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 105193237
[(2,6-difluoro-3-methylphenyl)-(4-fluoro-3-methylphenyl)methyl]hydrazine
CID 105204027
[(4-fluoro-3-methylphenyl)-(3-methoxythiophen-2-yl)methyl]hydrazine
CID 105302690

Frequently Asked Questions

What is the IUPAC name of [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine?
The IUPAC name of [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine (CID 105302694) is [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine?
The canonical SMILES for [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine is Cc1cc(C(NN)c2snnc2C(C)(C)C)ccc1F.
What is the InChIKey of [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine?
The InChIKey is IOWQXDBMOZOQKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19FN4S/c1-8-7-9(5-6-10(8)15)11(17-16)12-13(14(2,3)4)18-19-20-12/h5-7,11,17H,16H2,1-4H3.
What are the key properties of [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine?
[(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine has a molecular weight of 294.40 g/mol, XLogP of 2.84, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-tert-butylthiadiazol-5-yl)-(4-fluoro-3-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105302694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).