(NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine

C14H13NO2 — CID 14927109

IUPAC(NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine
SMILESCOc1ccccc1/C(=N/O)c1ccccc1
InChIInChI=1S/C14H13NO2/c1-17-13-10-6-5-9-12(13)14(15-16)11-7-3-2-4-8-11/h2-10,16H,1H3/b15-14+
InChIKeyKFLSXDJKRFVOHP-CCEZHUSRSA-N
MW227.26 g/mol
LogP2.92
Rot. Bonds3

About (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine

(NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine (PubChem CID 14927109) has the molecular formula C14H13NO2 and a molecular weight of 227.26 g/mol. Its IUPAC name is (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine.

Molecular Properties

Compound Name(NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine
PubChem CID14927109
Molecular FormulaC14H13NO2
Molecular Weight227.26 g/mol
Exact Mass227.09
IUPAC Name(NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine
SMILESCOc1ccccc1/C(=N/O)c1ccccc1
InChIInChI=1S/C14H13NO2/c1-17-13-10-6-5-9-12(13)14(15-16)11-7-3-2-4-8-11/h2-10,16H,1H3/b15-14+
InChIKeyKFLSXDJKRFVOHP-CCEZHUSRSA-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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Related Compounds

N-[(2,3-dimethoxyphenyl)-phenylmethylidene]hydroxylamine
CID 154085721
(NE)-N-[(2-methylphenyl)-phenylmethylidene]hydroxylamine
CID 12003652
1-[(E)-1,2-diiodo-2-phenylethenyl]-2-methoxybenzene
CID 122376703
2-methoxy-N-[(4-methylphenyl)-phenylmethylidene]benzamide
CID 4674835
6-[(E)-N-hydroxy-C-phenylcarbonimidoyl]-5,8-dimethoxynaphthalene-1,4-dione
CID 11209917
(NZ)-N-[(2-aminophenyl)-phenylmethylidene]hydroxylamine
CID 5376029
N-[(2,4-dimethoxyphenyl)-(4-methylphenyl)methylidene]hydroxylamine
CID 88635833
(NZ)-N-[(4-methylphenyl)-phenylmethylidene]hydroxylamine
CID 6303063
N-[[(2,3-dimethoxyphenyl)-phenylmethylidene]amino]-N-phenylaniline
CID 57264316
2-methoxy-N-[[phenyl(pyridin-4-yl)methylidene]amino]benzamide;hydrochloride
CID 88671183
1-[2-[(E)-N-hydroxy-C-(4-methylphenyl)carbonimidoyl]phenyl]-3-phenylpropane-1,3-dione
CID 11783265
2-methoxy-3-(2-methoxyphenyl)-3-oxopropanoic acid
CID 54172457

Frequently Asked Questions

What is the IUPAC name of (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine?
The IUPAC name of (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine (CID 14927109) is (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine.
What is the SMILES notation for (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine?
The canonical SMILES for (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine is COc1ccccc1/C(=N/O)c1ccccc1.
What is the InChIKey of (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine?
The InChIKey is KFLSXDJKRFVOHP-CCEZHUSRSA-N. The full InChI is InChI=1S/C14H13NO2/c1-17-13-10-6-5-9-12(13)14(15-16)11-7-3-2-4-8-11/h2-10,16H,1H3/b15-14+.
What are the key properties of (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine?
(NE)-N-[(2-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 (NE)-N-[(2-methoxyphenyl)-phenylmethylidene]hydroxylamine is sourced from PubChem (CID 14927109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).