(NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine

C10H9NO3 — CID 177496545

IUPAC(NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine
SMILESCOc1cccc2c(/C=N\O)coc12
InChIInChI=1S/C10H9NO3/c1-13-9-4-2-3-8-7(5-11-12)6-14-10(8)9/h2-6,12H,1H3/b11-5-
InChIKeyPWACZLCECJPQCN-WZUFQYTHSA-N
MW191.19 g/mol
LogP2.25
Rot. Bonds2

About (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine

(NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine (PubChem CID 177496545) has the molecular formula C10H9NO3 and a molecular weight of 191.19 g/mol. Its IUPAC name is (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine
PubChem CID177496545
Molecular FormulaC10H9NO3
Molecular Weight191.19 g/mol
Exact Mass191.06
IUPAC Name(NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine
SMILESCOc1cccc2c(/C=N\O)coc12
InChIInChI=1S/C10H9NO3/c1-13-9-4-2-3-8-7(5-11-12)6-14-10(8)9/h2-6,12H,1H3/b11-5-
InChIKeyPWACZLCECJPQCN-WZUFQYTHSA-N
XLogP2.25
TPSA54.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.19
LogP ≤ 52.25
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-[(E)-hydroxyiminomethyl]-6-methoxyphenol
CID 135460299
2-(7-methoxy-1-benzofuran-3-yl)ethanol
CID 22662935
(NE)-N-[(2-ethoxy-3-methoxyphenyl)methylidene]hydroxylamine
CID 23722991
2-[(E)-hydroxyiminomethyl]-3-methoxyphenol
CID 135755375
(NE)-N-[[3-methoxy-2-(naphthalen-1-ylmethoxy)phenyl]methylidene]hydroxylamine
CID 42252267
1-(7-methoxy-1-benzofuran-3-yl)-3,3-dimethylbutan-2-one
CID 146470701
(NE)-N-[(2-cyclopentyloxy-3-methoxyphenyl)methylidene]hydroxylamine
CID 87204181
(NE)-N-[(3-methoxy-2-prop-2-ynoxyphenyl)methylidene]hydroxylamine
CID 10104391
2-(7-methoxy-1-benzofuran-3-yl)acetonitrile
CID 15618729
(2R)-2-[2-(hydroxyiminomethyl)-6-methoxyphenoxy]propanoic acid
CID 126251082
ethyl 2-(7-methoxy-1-benzofuran-3-yl)acetate
CID 22734085
N-[[3-methoxy-2-(2-phenoxyethoxy)phenyl]methylidene]hydroxylamine
CID 22682151

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine (CID 177496545) is (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine is COc1cccc2c(/C=N\O)coc12.
What is the InChIKey of (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine?
The InChIKey is PWACZLCECJPQCN-WZUFQYTHSA-N. The full InChI is InChI=1S/C10H9NO3/c1-13-9-4-2-3-8-7(5-11-12)6-14-10(8)9/h2-6,12H,1H3/b11-5-.
What are the key properties of (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine?
(NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine has a molecular weight of 191.19 g/mol, XLogP of 2.25, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(7-methoxy-1-benzofuran-3-yl)methylidene]hydroxylamine is sourced from PubChem (CID 177496545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).