(NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine

C16H15NO — CID 20741114

IUPAC(NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine
SMILESC=Cc1ccc(/C(Cc2ccccc2)=N/O)cc1
InChIInChI=1S/C16H15NO/c1-2-13-8-10-15(11-9-13)16(17-18)12-14-6-4-3-5-7-14/h2-11,18H,1,12H2/b17-16+
InChIKeyACYLZQMDSVAPKF-WUKNDPDISA-N
MW237.30 g/mol
LogP3.75
Rot. Bonds4

About (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine

(NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine (PubChem CID 20741114) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine
PubChem CID20741114
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name(NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine
SMILESC=Cc1ccc(/C(Cc2ccccc2)=N/O)cc1
InChIInChI=1S/C16H15NO/c1-2-13-8-10-15(11-9-13)16(17-18)12-14-6-4-3-5-7-14/h2-11,18H,1,12H2/b17-16+
InChIKeyACYLZQMDSVAPKF-WUKNDPDISA-N
XLogP3.75
TPSA32.59 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 53.75
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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Related Compounds

(NZ)-N-[2-phenyl-1-(4-phenylphenyl)ethylidene]hydroxylamine
CID 6381176
(NZ)-N-[1-(4-fluorophenyl)-2-phenylethylidene]hydroxylamine
CID 22277781
(NE)-N-[1-(4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
CID 10060245
hydroxylamine;styrene
CID 18314782
(NE)-N-[1-[4-[tert-butyl(dimethyl)silyl]oxyphenyl]-2-phenylethylidene]hydroxylamine
CID 59857614
(5E)-5-hydroxyimino-5-phenylpent-1-en-3-ol
CID 139841509
4-[(Z)-C-benzyl-N-hydroxycarbonimidoyl]-2-methoxyphenol
CID 136826320
4-ethenylbenzoic acid;styrene
CID 22341601
N-[2-(4-nitrophenyl)-1-phenylethylidene]hydroxylamine
CID 71393953
(4-ethenylphenyl)methyl 2-phenylacetate
CID 164760837
N-[2-(3,4-dimethylphenyl)-1-phenylethylidene]hydroxylamine
CID 174958902
(NE)-N-[1-(3-fluoro-4-methoxyphenyl)-2-phenylethylidene]hydroxylamine
CID 19608702

Frequently Asked Questions

What is the IUPAC name of (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine?
The IUPAC name of (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine (CID 20741114) is (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine is C=Cc1ccc(/C(Cc2ccccc2)=N/O)cc1.
What is the InChIKey of (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine?
The InChIKey is ACYLZQMDSVAPKF-WUKNDPDISA-N. The full InChI is InChI=1S/C16H15NO/c1-2-13-8-10-15(11-9-13)16(17-18)12-14-6-4-3-5-7-14/h2-11,18H,1,12H2/b17-16+.
What are the key properties of (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine?
(NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine has a molecular weight of 237.30 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-[1-(4-ethenylphenyl)-2-phenylethylidene]hydroxylamine is sourced from PubChem (CID 20741114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).