[2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine

C14H19N3S — CID 116892119

IUPAC[2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine
SMILESCc1cc(C(C)(C)C)ccc1-c1nc(NN)cs1
InChIInChI=1S/C14H19N3S/c1-9-7-10(14(2,3)4)5-6-11(9)13-16-12(17-15)8-18-13/h5-8,17H,15H2,1-4H3
InChIKeyHPTYMEQQHHDAGU-UHFFFAOYSA-N
MW261.39 g/mol
LogP3.70
Rot. Bonds2

About [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine

[2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine (PubChem CID 116892119) has the molecular formula C14H19N3S and a molecular weight of 261.39 g/mol. Its IUPAC name is [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine.

Molecular Properties

Compound Name[2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine
PubChem CID116892119
Molecular FormulaC14H19N3S
Molecular Weight261.39 g/mol
Exact Mass261.13
IUPAC Name[2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine
SMILESCc1cc(C(C)(C)C)ccc1-c1nc(NN)cs1
InChIInChI=1S/C14H19N3S/c1-9-7-10(14(2,3)4)5-6-11(9)13-16-12(17-15)8-18-13/h5-8,17H,15H2,1-4H3
InChIKeyHPTYMEQQHHDAGU-UHFFFAOYSA-N
XLogP3.70
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.39
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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

2-(4-tert-butyl-2-methylphenyl)-4-chloro-1,3-thiazole
CID 116892310
2-(4-tert-butyl-2-methylphenyl)-1,3-thiazole-4-carbonitrile
CID 116889953
[2-(7-methyl-2,3-dihydro-1,4-benzodioxin-6-yl)-1,3-thiazol-4-yl]hydrazine
CID 116892108
[2-(2,4-dichlorophenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892139
[4-(5-tert-butyl-2-methylphenyl)-1,3-thiazol-2-yl]hydrazine
CID 39103646
[2-(2-fluorophenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892142
[2-(2,5-difluorophenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892077
[2-(5-methylfuran-2-yl)-1,3-thiazol-4-yl]hydrazine
CID 116892150
[2-(2-methoxy-4,6-dimethylphenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892118
4-(4-tert-butyl-2-methylphenyl)-2-methyl-1,3-thiazol-5-amine
CID 82484831
[2-(4-chlorophenyl)-1,3-thiazol-4-yl]hydrazine
CID 116892044
[2-(2-methyl-1,3-benzoxazol-5-yl)-1,3-thiazol-4-yl]hydrazine
CID 116892127

Frequently Asked Questions

What is the IUPAC name of [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine?
The IUPAC name of [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine (CID 116892119) is [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine.
What is the SMILES notation for [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine?
The canonical SMILES for [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine is Cc1cc(C(C)(C)C)ccc1-c1nc(NN)cs1.
What is the InChIKey of [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine?
The InChIKey is HPTYMEQQHHDAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3S/c1-9-7-10(14(2,3)4)5-6-11(9)13-16-12(17-15)8-18-13/h5-8,17H,15H2,1-4H3.
What are the key properties of [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine?
[2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine has a molecular weight of 261.39 g/mol, XLogP of 3.70, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-tert-butyl-2-methylphenyl)-1,3-thiazol-4-yl]hydrazine is sourced from PubChem (CID 116892119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).