(NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine

C9H10INO3 — CID 5407943

IUPAC(NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine
SMILESCOc1cc(/C=N\O)cc(I)c1OC
InChIInChI=1S/C9H10INO3/c1-13-8-4-6(5-11-12)3-7(10)9(8)14-2/h3-5,12H,1-2H3/b11-5-
InChIKeyXWSRLDIBKGPNKA-WZUFQYTHSA-N
MW307.09 g/mol
LogP2.12
Rot. Bonds3

About (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine

(NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine (PubChem CID 5407943) has the molecular formula C9H10INO3 and a molecular weight of 307.09 g/mol. Its IUPAC name is (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine
PubChem CID5407943
Molecular FormulaC9H10INO3
Molecular Weight307.09 g/mol
Exact Mass306.97
IUPAC Name(NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine
SMILESCOc1cc(/C=N\O)cc(I)c1OC
InChIInChI=1S/C9H10INO3/c1-13-8-4-6(5-11-12)3-7(10)9(8)14-2/h3-5,12H,1-2H3/b11-5-
InChIKeyXWSRLDIBKGPNKA-WZUFQYTHSA-N
XLogP2.12
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.09
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-[(E)-hydroxyiminomethyl]-2-iodo-6-methoxyphenoxy]ethanol
CID 19617662
N-[[4-[(2-chlorophenyl)methoxy]-3-iodo-5-methoxyphenyl]methylidene]hydroxylamine
CID 1311678
(NZ)-N-[[3-iodo-5-methoxy-4-(pyridin-3-ylmethoxy)phenyl]methylidene]hydroxylamine
CID 91682653
(NZ)-N-[[4-(2,4-dinitrophenoxy)-3-iodo-5-methoxyphenyl]methylidene]hydroxylamine
CID 126091675
N-[(3-ethoxy-5-iodo-4-propoxyphenyl)methylidene]hydroxylamine
CID 57360358
(NE)-N-[(4-methoxy-3,5-dimethylphenyl)methylidene]hydroxylamine
CID 58938988
(NZ)-N-[(4-methoxy-3,5-dimethylphenyl)methylidene]hydroxylamine
CID 87388843
2-[4-[(E)-hydroxyiminomethyl]-2-iodo-6-methoxyphenoxy]-N-(2-methylphenyl)acetamide
CID 126269915
N-(2-chlorophenyl)-2-[4-[(E)-hydroxyiminomethyl]-2-iodo-6-methoxyphenoxy]acetamide
CID 126277187
2-amino-4-(hydroxyiminomethyl)-6-methoxyphenol
CID 171131966
(3-ethoxy-5-iodo-4-methoxyphenyl)methylidenehydrazine
CID 168530777
(NZ)-N-[(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)methylidene]hydroxylamine
CID 5398997

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine (CID 5407943) is (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine is COc1cc(/C=N\O)cc(I)c1OC.
What is the InChIKey of (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine?
The InChIKey is XWSRLDIBKGPNKA-WZUFQYTHSA-N. The full InChI is InChI=1S/C9H10INO3/c1-13-8-4-6(5-11-12)3-7(10)9(8)14-2/h3-5,12H,1-2H3/b11-5-.
What are the key properties of (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine?
(NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine has a molecular weight of 307.09 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(3-iodo-4,5-dimethoxyphenyl)methylidene]hydroxylamine is sourced from PubChem (CID 5407943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).