(NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine

C13H10N2O3 — CID 6506582

IUPAC(NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine
SMILESO=[N+]([O-])c1ccc(/C(=N\O)c2ccccc2)cc1
InChIInChI=1S/C13H10N2O3/c16-14-13(10-4-2-1-3-5-10)11-6-8-12(9-7-11)15(17)18/h1-9,16H/b14-13-
InChIKeyLNOLJFCCYQZFBQ-YPKPFQOOSA-N
MW242.23 g/mol
LogP2.82
Rot. Bonds3

About (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine

(NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine (PubChem CID 6506582) has the molecular formula C13H10N2O3 and a molecular weight of 242.23 g/mol. Its IUPAC name is (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine
PubChem CID6506582
Molecular FormulaC13H10N2O3
Molecular Weight242.23 g/mol
Exact Mass242.07
IUPAC Name(NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine
SMILESO=[N+]([O-])c1ccc(/C(=N\O)c2ccccc2)cc1
InChIInChI=1S/C13H10N2O3/c16-14-13(10-4-2-1-3-5-10)11-6-8-12(9-7-11)15(17)18/h1-9,16H/b14-13-
InChIKeyLNOLJFCCYQZFBQ-YPKPFQOOSA-N
XLogP2.82
TPSA75.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.23
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]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-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine (CID 6506582) is (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine is O=[N+]([O-])c1ccc(/C(=N\O)c2ccccc2)cc1.
What is the InChIKey of (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine?
The InChIKey is LNOLJFCCYQZFBQ-YPKPFQOOSA-N. The full InChI is InChI=1S/C13H10N2O3/c16-14-13(10-4-2-1-3-5-10)11-6-8-12(9-7-11)15(17)18/h1-9,16H/b14-13-.
What are the key properties of (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine?
(NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine has a molecular weight of 242.23 g/mol, XLogP of 2.82, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(4-nitrophenyl)-phenylmethylidene]hydroxylamine is sourced from PubChem (CID 6506582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).