(NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine

C10H13NO3 — CID 6199793

IUPAC(NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine
SMILESCCOc1cc(/C=N\O)ccc1OC
InChIInChI=1S/C10H13NO3/c1-3-14-10-6-8(7-11-12)4-5-9(10)13-2/h4-7,12H,3H2,1-2H3/b11-7-
InChIKeyFVYXOGUMKIMTAT-XFFZJAGNSA-N
MW195.22 g/mol
LogP1.90
Rot. Bonds4

About (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine

(NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine (PubChem CID 6199793) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine
PubChem CID6199793
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name(NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine
SMILESCCOc1cc(/C=N\O)ccc1OC
InChIInChI=1S/C10H13NO3/c1-3-14-10-6-8(7-11-12)4-5-9(10)13-2/h4-7,12H,3H2,1-2H3/b11-7-
InChIKeyFVYXOGUMKIMTAT-XFFZJAGNSA-N
XLogP1.90
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 51.90
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'}

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Related Compounds

2-[2-ethoxy-4-(hydroxyiminomethyl)phenoxy]acetamide
CID 1223156
N-[(3-hexoxy-4-methoxyphenyl)methylidene]hydroxylamine
CID 20986617
2-ethoxy-4-[(Z)-hydroxyiminomethyl]phenol
CID 135832909
2-[(3-ethoxy-4-methoxyphenyl)methylideneamino]guanidine
CID 2716681
2-[5-[(E)-hydroxyiminomethyl]-2-methoxyphenoxy]acetic acid
CID 87800721
(NZ)-N-[[3-[(4-fluorophenyl)methoxy]-4-methoxyphenyl]methylidene]hydroxylamine
CID 91681635
4-ethenyl-2-ethoxy-1-methoxybenzene
CID 11665489
N-[[3-[2-(4-fluorophenoxy)ethoxy]-4-methoxyphenyl]methylidene]hydroxylamine
CID 20992695
N-[[3-[2-(2,4-dichlorophenoxy)ethoxy]-4-methoxyphenyl]methylidene]hydroxylamine
CID 22679937
N-[[3-[2-(2,6-dimethylphenoxy)ethoxy]-4-methoxyphenyl]methylidene]hydroxylamine
CID 22685000
(NE)-N-[[3-[2-(2,5-dimethylphenoxy)ethoxy]-4-methoxyphenyl]methylidene]hydroxylamine
CID 42337956
2-ethoxy-5-(hydroxyiminomethyl)benzoic acid
CID 4769996

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine (CID 6199793) is (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine is CCOc1cc(/C=N\O)ccc1OC.
What is the InChIKey of (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine?
The InChIKey is FVYXOGUMKIMTAT-XFFZJAGNSA-N. The full InChI is InChI=1S/C10H13NO3/c1-3-14-10-6-8(7-11-12)4-5-9(10)13-2/h4-7,12H,3H2,1-2H3/b11-7-.
What are the key properties of (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine?
(NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine has a molecular weight of 195.22 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(3-ethoxy-4-methoxyphenyl)methylidene]hydroxylamine is sourced from PubChem (CID 6199793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).