N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine

C19H16NOP — CID 71317484

IUPACN-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine
SMILESON=Cc1ccccc1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H16NOP/c21-20-15-16-9-7-8-14-19(16)22(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15,21H
InChIKeyXHIVESUSSLEMGJ-UHFFFAOYSA-N
MW305.32 g/mol
LogP3.25
Rot. Bonds4

About N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine

N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine (PubChem CID 71317484) has the molecular formula C19H16NOP and a molecular weight of 305.32 g/mol. Its IUPAC name is N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine.

Molecular Properties

Compound NameN-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine
PubChem CID71317484
Molecular FormulaC19H16NOP
Molecular Weight305.32 g/mol
Exact Mass305.10
IUPAC NameN-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine
SMILESON=Cc1ccccc1P(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H16NOP/c21-20-15-16-9-7-8-14-19(16)22(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15,21H
InChIKeyXHIVESUSSLEMGJ-UHFFFAOYSA-N
XLogP3.25
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.32
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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'}, {'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine?
The IUPAC name of N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine (CID 71317484) is N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine.
What is the SMILES notation for N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine?
The canonical SMILES for N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine is ON=Cc1ccccc1P(c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine?
The InChIKey is XHIVESUSSLEMGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16NOP/c21-20-15-16-9-7-8-14-19(16)22(17-10-3-1-4-11-17)18-12-5-2-6-13-18/h1-15,21H.
What are the key properties of N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine?
N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine has a molecular weight of 305.32 g/mol, XLogP of 3.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-diphenylphosphanylphenyl)methylidene]hydroxylamine is sourced from PubChem (CID 71317484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).