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

C14H13NO2 — CID 6108781

IUPAC(NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine
SMILESCOc1ccc(/C(=N\O)c2ccccc2)cc1
InChIInChI=1S/C14H13NO2/c1-17-13-9-7-12(8-10-13)14(15-16)11-5-3-2-4-6-11/h2-10,16H,1H3/b15-14-
InChIKeyPHKAHRGUQKGTCV-PFONDFGASA-N
MW227.26 g/mol
LogP2.92
Rot. Bonds3

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

(NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine (PubChem CID 6108781) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine
PubChem CID6108781
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name(NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine
SMILESCOc1ccc(/C(=N\O)c2ccccc2)cc1
InChIInChI=1S/C14H13NO2/c1-17-13-9-7-12(8-10-13)14(15-16)11-5-3-2-4-6-11/h2-10,16H,1H3/b15-14-
InChIKeyPHKAHRGUQKGTCV-PFONDFGASA-N
XLogP2.92
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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'}

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Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine (CID 6108781) is (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine is COc1ccc(/C(=N\O)c2ccccc2)cc1.
What is the InChIKey of (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine?
The InChIKey is PHKAHRGUQKGTCV-PFONDFGASA-N. The full InChI is InChI=1S/C14H13NO2/c1-17-13-9-7-12(8-10-13)14(15-16)11-5-3-2-4-6-11/h2-10,16H,1H3/b15-14-.
What are the key properties of (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine?
(NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine has a molecular weight of 227.26 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(4-methoxyphenyl)-phenylmethylidene]hydroxylamine is sourced from PubChem (CID 6108781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).