2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide

C11H11N3OS — CID 7131215

IUPAC2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide
SMILESNNC(=O)Cc1nc(-c2ccccc2)cs1
InChIInChI=1S/C11H11N3OS/c12-14-10(15)6-11-13-9(7-16-11)8-4-2-1-3-5-8/h1-5,7H,6,12H2,(H,14,15)
InChIKeyHMSHIOWVUCPJNA-UHFFFAOYSA-N
MW233.30 g/mol
LogP1.34
Rot. Bonds3

About 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide

2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide (PubChem CID 7131215) has the molecular formula C11H11N3OS and a molecular weight of 233.30 g/mol. Its IUPAC name is 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide.

Molecular Properties

Compound Name2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide
PubChem CID7131215
Molecular FormulaC11H11N3OS
Molecular Weight233.30 g/mol
Exact Mass233.06
IUPAC Name2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide
SMILESNNC(=O)Cc1nc(-c2ccccc2)cs1
InChIInChI=1S/C11H11N3OS/c12-14-10(15)6-11-13-9(7-16-11)8-4-2-1-3-5-8/h1-5,7H,6,12H2,(H,14,15)
InChIKeyHMSHIOWVUCPJNA-UHFFFAOYSA-N
XLogP1.34
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.30
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'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 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide?
The IUPAC name of 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide (CID 7131215) is 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide.
What is the SMILES notation for 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide?
The canonical SMILES for 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide is NNC(=O)Cc1nc(-c2ccccc2)cs1.
What is the InChIKey of 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide?
The InChIKey is HMSHIOWVUCPJNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3OS/c12-14-10(15)6-11-13-9(7-16-11)8-4-2-1-3-5-8/h1-5,7H,6,12H2,(H,14,15).
What are the key properties of 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide?
2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide has a molecular weight of 233.30 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-phenyl-1,3-thiazol-2-yl)acetohydrazide is sourced from PubChem (CID 7131215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).