(NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine

C9H9N3OS2 — CID 135415453

IUPAC(NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine
SMILESCc1csc(/C(=N\O)c2csc(C)n2)n1
InChIInChI=1S/C9H9N3OS2/c1-5-3-15-9(10-5)8(12-13)7-4-14-6(2)11-7/h3-4,13H,1-2H3/b12-8-
InChIKeyCDZGZYLUATTZSQ-WQLSENKSSA-N
MW239.32 g/mol
LogP2.44
Rot. Bonds2

About (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine

(NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine (PubChem CID 135415453) has the molecular formula C9H9N3OS2 and a molecular weight of 239.32 g/mol. Its IUPAC name is (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine
PubChem CID135415453
Molecular FormulaC9H9N3OS2
Molecular Weight239.32 g/mol
Exact Mass239.02
IUPAC Name(NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine
SMILESCc1csc(/C(=N\O)c2csc(C)n2)n1
InChIInChI=1S/C9H9N3OS2/c1-5-3-15-9(10-5)8(12-13)7-4-14-6(2)11-7/h3-4,13H,1-2H3/b12-8-
InChIKeyCDZGZYLUATTZSQ-WQLSENKSSA-N
XLogP2.44
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine (CID 135415453) is (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine is Cc1csc(/C(=N\O)c2csc(C)n2)n1.
What is the InChIKey of (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine?
The InChIKey is CDZGZYLUATTZSQ-WQLSENKSSA-N. The full InChI is InChI=1S/C9H9N3OS2/c1-5-3-15-9(10-5)8(12-13)7-4-14-6(2)11-7/h3-4,13H,1-2H3/b12-8-.
What are the key properties of (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine?
(NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine has a molecular weight of 239.32 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(2-methyl-1,3-thiazol-4-yl)-(4-methyl-1,3-thiazol-2-yl)methylidene]hydroxylamine is sourced from PubChem (CID 135415453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).