1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol

C20H19NO3 — CID 135596070

IUPAC1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol
SMILESCOc1ccccc1OCC/N=C/c1c(O)ccc2ccccc12
InChIInChI=1S/C20H19NO3/c1-23-19-8-4-5-9-20(19)24-13-12-21-14-17-16-7-3-2-6-15(16)10-11-18(17)22/h2-11,14,22H,12-13H2,1H3/b21-14+
InChIKeyBZVBZHSRBMINEQ-KGENOOAVSA-N
MW321.38 g/mol
LogP4.05
Rot. Bonds6

About 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol

1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol (PubChem CID 135596070) has the molecular formula C20H19NO3 and a molecular weight of 321.38 g/mol. Its IUPAC name is 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol
PubChem CID135596070
Molecular FormulaC20H19NO3
Molecular Weight321.38 g/mol
Exact Mass321.14
IUPAC Name1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol
SMILESCOc1ccccc1OCC/N=C/c1c(O)ccc2ccccc12
InChIInChI=1S/C20H19NO3/c1-23-19-8-4-5-9-20(19)24-13-12-21-14-17-16-7-3-2-6-15(16)10-11-18(17)22/h2-11,14,22H,12-13H2,1H3/b21-14+
InChIKeyBZVBZHSRBMINEQ-KGENOOAVSA-N
XLogP4.05
TPSA51.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-[(2-methoxyphenyl)methyliminomethyl]naphthalen-2-ol
CID 135595588
N-[(Z)-(2-hydroxynaphthalen-1-yl)methylideneamino]-2-(2-methoxyphenoxy)acetamide
CID 136750606
1-(pentyliminomethyl)naphthalen-2-ol
CID 137231972
1-[[(2S)-2-(2-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]iminomethyl]naphthalen-2-ol
CID 135758184
1-[(4,5-dimethoxy-2-methylphenyl)iminomethyl]naphthalen-2-ol
CID 135595898
1-[2-(naphthalen-1-ylamino)ethyliminomethyl]naphthalen-2-ol
CID 137270230
1-[(E)-hydroxyiminomethyl]naphthalen-2-ol
CID 135400485
N-[(E)-(2-hydroxynaphthalen-1-yl)methylideneamino]-2-(2-methoxyanilino)propanamide
CID 135683629
(2S)-N-[(Z)-(2-hydroxynaphthalen-1-yl)methylideneamino]-2-(2-methoxyanilino)propanamide
CID 136790489
N-[(2-hydroxynaphthalen-1-yl)methylidene]-4-methoxybenzenesulfonamide
CID 148783161
1-(propan-2-yliminomethyl)naphthalen-2-ol
CID 4779256
N-[(2-methoxynaphthalen-1-yl)methylidene]hydroxylamine
CID 708036

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol?
The IUPAC name of 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol (CID 135596070) is 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol.
What is the SMILES notation for 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol?
The canonical SMILES for 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol is COc1ccccc1OCC/N=C/c1c(O)ccc2ccccc12.
What is the InChIKey of 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol?
The InChIKey is BZVBZHSRBMINEQ-KGENOOAVSA-N. The full InChI is InChI=1S/C20H19NO3/c1-23-19-8-4-5-9-20(19)24-13-12-21-14-17-16-7-3-2-6-15(16)10-11-18(17)22/h2-11,14,22H,12-13H2,1H3/b21-14+.
What are the key properties of 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol?
1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol has a molecular weight of 321.38 g/mol, XLogP of 4.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2-methoxyphenoxy)ethyliminomethyl]naphthalen-2-ol is sourced from PubChem (CID 135596070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).