(NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine

C9H11NO — CID 5385523

IUPAC(NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine
SMILESC/C(=N/O)c1ccc(C)cc1
InChIInChI=1S/C9H11NO/c1-7-3-5-9(6-4-7)8(2)10-11/h3-6,11H,1-2H3/b10-8-
InChIKeyXAAUYUMBCPRWED-NTMALXAHSA-N
MW149.19 g/mol
LogP2.19
Rot. Bonds1

About (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine

(NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine (PubChem CID 5385523) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine
PubChem CID5385523
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name(NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine
SMILESC/C(=N/O)c1ccc(C)cc1
InChIInChI=1S/C9H11NO/c1-7-3-5-9(6-4-7)8(2)10-11/h3-6,11H,1-2H3/b10-8-
InChIKeyXAAUYUMBCPRWED-NTMALXAHSA-N
XLogP2.19
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 52.19
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'}

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Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine (CID 5385523) is (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine is C/C(=N/O)c1ccc(C)cc1.
What is the InChIKey of (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine?
The InChIKey is XAAUYUMBCPRWED-NTMALXAHSA-N. The full InChI is InChI=1S/C9H11NO/c1-7-3-5-9(6-4-7)8(2)10-11/h3-6,11H,1-2H3/b10-8-.
What are the key properties of (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine?
(NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine has a molecular weight of 149.19 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine is sourced from PubChem (CID 5385523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).