(NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine

C23H23NO6 — CID 134151517

IUPAC(NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine
SMILESCOc1cc2cc(/C(=N\O)c3ccc4c(c3OC)C=CC(C)(C)O4)oc2cc1OC
InChIInChI=1S/C23H23NO6/c1-23(2)9-8-14-16(30-23)7-6-15(22(14)28-5)21(24-25)20-11-13-10-18(26-3)19(27-4)12-17(13)29-20/h6-12,25H,1-5H3/b24-21-
InChIKeyDPVMUZXIRORIHI-FLFQWRMESA-N
MW409.44 g/mol
LogP4.87
Rot. Bonds5

About (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine

(NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine (PubChem CID 134151517) has the molecular formula C23H23NO6 and a molecular weight of 409.44 g/mol. Its IUPAC name is (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine.

Molecular Properties

Compound Name(NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine
PubChem CID134151517
Molecular FormulaC23H23NO6
Molecular Weight409.44 g/mol
Exact Mass409.15
IUPAC Name(NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine
SMILESCOc1cc2cc(/C(=N\O)c3ccc4c(c3OC)C=CC(C)(C)O4)oc2cc1OC
InChIInChI=1S/C23H23NO6/c1-23(2)9-8-14-16(30-23)7-6-15(22(14)28-5)21(24-25)20-11-13-10-18(26-3)19(27-4)12-17(13)29-20/h6-12,25H,1-5H3/b24-21-
InChIKeyDPVMUZXIRORIHI-FLFQWRMESA-N
XLogP4.87
TPSA82.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.44
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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'}

Analyze (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)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

Frequently Asked Questions

What is the IUPAC name of (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine?
The IUPAC name of (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine (CID 134151517) is (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine.
What is the SMILES notation for (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine?
The canonical SMILES for (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine is COc1cc2cc(/C(=N\O)c3ccc4c(c3OC)C=CC(C)(C)O4)oc2cc1OC.
What is the InChIKey of (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine?
The InChIKey is DPVMUZXIRORIHI-FLFQWRMESA-N. The full InChI is InChI=1S/C23H23NO6/c1-23(2)9-8-14-16(30-23)7-6-15(22(14)28-5)21(24-25)20-11-13-10-18(26-3)19(27-4)12-17(13)29-20/h6-12,25H,1-5H3/b24-21-.
What are the key properties of (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine?
(NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine has a molecular weight of 409.44 g/mol, XLogP of 4.87, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (NZ)-N-[(5,6-dimethoxy-1-benzofuran-2-yl)-(5-methoxy-2,2-dimethylchromen-6-yl)methylidene]hydroxylamine is sourced from PubChem (CID 134151517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).