1-[(E)-methoxyiminomethyl]naphthalen-2-ol

C12H11NO2 — CID 135588814

IUPAC1-[(E)-methoxyiminomethyl]naphthalen-2-ol
SMILESCO/N=C/c1c(O)ccc2ccccc12
InChIInChI=1S/C12H11NO2/c1-15-13-8-11-10-5-3-2-4-9(10)6-7-12(11)14/h2-8,14H,1H3/b13-8+
InChIKeyFJRFNOOZFKTDDL-MDWZMJQESA-N
MW201.22 g/mol
LogP2.53
Rot. Bonds2

About 1-[(E)-methoxyiminomethyl]naphthalen-2-ol

1-[(E)-methoxyiminomethyl]naphthalen-2-ol (PubChem CID 135588814) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is 1-[(E)-methoxyiminomethyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(E)-methoxyiminomethyl]naphthalen-2-ol
PubChem CID135588814
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC Name1-[(E)-methoxyiminomethyl]naphthalen-2-ol
SMILESCO/N=C/c1c(O)ccc2ccccc12
InChIInChI=1S/C12H11NO2/c1-15-13-8-11-10-5-3-2-4-9(10)6-7-12(11)14/h2-8,14H,1H3/b13-8+
InChIKeyFJRFNOOZFKTDDL-MDWZMJQESA-N
XLogP2.53
TPSA41.82 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-[(E)-methoxyiminomethyl]naphthalen-2-ol 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 1-[(E)-methoxyiminomethyl]naphthalen-2-ol?
The IUPAC name of 1-[(E)-methoxyiminomethyl]naphthalen-2-ol (CID 135588814) is 1-[(E)-methoxyiminomethyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(E)-methoxyiminomethyl]naphthalen-2-ol?
The canonical SMILES for 1-[(E)-methoxyiminomethyl]naphthalen-2-ol is CO/N=C/c1c(O)ccc2ccccc12.
What is the InChIKey of 1-[(E)-methoxyiminomethyl]naphthalen-2-ol?
The InChIKey is FJRFNOOZFKTDDL-MDWZMJQESA-N. The full InChI is InChI=1S/C12H11NO2/c1-15-13-8-11-10-5-3-2-4-9(10)6-7-12(11)14/h2-8,14H,1H3/b13-8+.
What are the key properties of 1-[(E)-methoxyiminomethyl]naphthalen-2-ol?
1-[(E)-methoxyiminomethyl]naphthalen-2-ol has a molecular weight of 201.22 g/mol, XLogP of 2.53, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-methoxyiminomethyl]naphthalen-2-ol is sourced from PubChem (CID 135588814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).