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

C11H13N3S — CID 116887834

IUPAC[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine
SMILESCc1cccc(-c2nc(C)c(NN)s2)c1
InChIInChI=1S/C11H13N3S/c1-7-4-3-5-9(6-7)11-13-8(2)10(14-12)15-11/h3-6,14H,12H2,1-2H3
InChIKeyBMLLCTZYTCZGEP-UHFFFAOYSA-N
MW219.31 g/mol
LogP2.71
Rot. Bonds2

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

[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine (PubChem CID 116887834) has the molecular formula C11H13N3S and a molecular weight of 219.31 g/mol. Its IUPAC name is [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine.

Molecular Properties

Compound Name[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine
PubChem CID116887834
Molecular FormulaC11H13N3S
Molecular Weight219.31 g/mol
Exact Mass219.08
IUPAC Name[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine
SMILESCc1cccc(-c2nc(C)c(NN)s2)c1
InChIInChI=1S/C11H13N3S/c1-7-4-3-5-9(6-7)11-13-8(2)10(14-12)15-11/h3-6,14H,12H2,1-2H3
InChIKeyBMLLCTZYTCZGEP-UHFFFAOYSA-N
XLogP2.71
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.31
LogP ≤ 52.71
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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Frequently Asked Questions

What is the IUPAC name of [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine?
The IUPAC name of [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine (CID 116887834) is [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine.
What is the SMILES notation for [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine?
The canonical SMILES for [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine is Cc1cccc(-c2nc(C)c(NN)s2)c1.
What is the InChIKey of [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine?
The InChIKey is BMLLCTZYTCZGEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3S/c1-7-4-3-5-9(6-7)11-13-8(2)10(14-12)15-11/h3-6,14H,12H2,1-2H3.
What are the key properties of [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine?
[4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine has a molecular weight of 219.31 g/mol, XLogP of 2.71, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-methyl-2-(3-methylphenyl)-1,3-thiazol-5-yl]hydrazine is sourced from PubChem (CID 116887834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).