(NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine

C10H14NO3P — CID 6082545

IUPAC(NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine
SMILESCOP(C)(=O)/C(Cc1ccccc1)=N\O
InChIInChI=1S/C10H14NO3P/c1-14-15(2,13)10(11-12)8-9-6-4-3-5-7-9/h3-7,12H,8H2,1-2H3/b11-10-
InChIKeyNFNSCRWAQXPMNQ-KHPPLWFESA-N
MW227.20 g/mol
LogP2.57
Rot. Bonds4

About (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine

(NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine (PubChem CID 6082545) has the molecular formula C10H14NO3P and a molecular weight of 227.20 g/mol. Its IUPAC name is (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine
PubChem CID6082545
Molecular FormulaC10H14NO3P
Molecular Weight227.20 g/mol
Exact Mass227.07
IUPAC Name(NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine
SMILESCOP(C)(=O)/C(Cc1ccccc1)=N\O
InChIInChI=1S/C10H14NO3P/c1-14-15(2,13)10(11-12)8-9-6-4-3-5-7-9/h3-7,12H,8H2,1-2H3/b11-10-
InChIKeyNFNSCRWAQXPMNQ-KHPPLWFESA-N
XLogP2.57
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.20
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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 (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine (CID 6082545) is (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine is COP(C)(=O)/C(Cc1ccccc1)=N\O.
What is the InChIKey of (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine?
The InChIKey is NFNSCRWAQXPMNQ-KHPPLWFESA-N. The full InChI is InChI=1S/C10H14NO3P/c1-14-15(2,13)10(11-12)8-9-6-4-3-5-7-9/h3-7,12H,8H2,1-2H3/b11-10-.
What are the key properties of (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine?
(NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine has a molecular weight of 227.20 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-[methoxy(methyl)phosphoryl]-2-phenylethylidene]hydroxylamine is sourced from PubChem (CID 6082545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).