2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol

C20H20N2O2 — CID 135434849

IUPAC2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol
SMILESCOc1cc(/C=N\N(C)Cc2cccc3ccccc23)ccc1O
InChIInChI=1S/C20H20N2O2/c1-22(21-13-15-10-11-19(23)20(12-15)24-2)14-17-8-5-7-16-6-3-4-9-18(16)17/h3-13,23H,14H2,1-2H3/b21-13-
InChIKeyLZAQBZZRBVZIQL-BKUYFWCQSA-N
MW320.39 g/mol
LogP4.02
Rot. Bonds5

About 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol

2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol (PubChem CID 135434849) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol.

Molecular Properties

Compound Name2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol
PubChem CID135434849
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC Name2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol
SMILESCOc1cc(/C=N\N(C)Cc2cccc3ccccc23)ccc1O
InChIInChI=1S/C20H20N2O2/c1-22(21-13-15-10-11-19(23)20(12-15)24-2)14-17-8-5-7-16-6-3-4-9-18(16)17/h3-13,23H,14H2,1-2H3/b21-13-
InChIKeyLZAQBZZRBVZIQL-BKUYFWCQSA-N
XLogP4.02
TPSA45.06 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_B(215)', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol?
The IUPAC name of 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol (CID 135434849) is 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol.
What is the SMILES notation for 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol?
The canonical SMILES for 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol is COc1cc(/C=N\N(C)Cc2cccc3ccccc23)ccc1O.
What is the InChIKey of 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol?
The InChIKey is LZAQBZZRBVZIQL-BKUYFWCQSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-22(21-13-15-10-11-19(23)20(12-15)24-2)14-17-8-5-7-16-6-3-4-9-18(16)17/h3-13,23H,14H2,1-2H3/b21-13-.
What are the key properties of 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol?
2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol has a molecular weight of 320.39 g/mol, XLogP of 4.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-4-[(Z)-[methyl(naphthalen-1-ylmethyl)hydrazinylidene]methyl]phenol is sourced from PubChem (CID 135434849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).