1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol

C19H16N2O2 — CID 135549426

IUPAC1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol
SMILESCOc1ccc(/C=N/N=C/c2c(O)ccc3ccccc23)cc1
InChIInChI=1S/C19H16N2O2/c1-23-16-9-6-14(7-10-16)12-20-21-13-18-17-5-3-2-4-15(17)8-11-19(18)22/h2-13,22H,1H3/b20-12+,21-13+
InChIKeyVDNHCZWTCMFPMX-ZIOPAAQOSA-N
MW304.35 g/mol
LogP4.01
Rot. Bonds4

About 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol

1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol (PubChem CID 135549426) has the molecular formula C19H16N2O2 and a molecular weight of 304.35 g/mol. Its IUPAC name is 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol.

Molecular Properties

Compound Name1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol
PubChem CID135549426
Molecular FormulaC19H16N2O2
Molecular Weight304.35 g/mol
Exact Mass304.12
IUPAC Name1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol
SMILESCOc1ccc(/C=N/N=C/c2c(O)ccc3ccccc23)cc1
InChIInChI=1S/C19H16N2O2/c1-23-16-9-6-14(7-10-16)12-20-21-13-18-17-5-3-2-4-15(17)8-11-19(18)22/h2-13,22H,1H3/b20-12+,21-13+
InChIKeyVDNHCZWTCMFPMX-ZIOPAAQOSA-N
XLogP4.01
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', '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 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol?
The IUPAC name of 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol (CID 135549426) is 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol.
What is the SMILES notation for 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol?
The canonical SMILES for 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol is COc1ccc(/C=N/N=C/c2c(O)ccc3ccccc23)cc1.
What is the InChIKey of 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol?
The InChIKey is VDNHCZWTCMFPMX-ZIOPAAQOSA-N. The full InChI is InChI=1S/C19H16N2O2/c1-23-16-9-6-14(7-10-16)12-20-21-13-18-17-5-3-2-4-15(17)8-11-19(18)22/h2-13,22H,1H3/b20-12+,21-13+.
What are the key properties of 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol?
1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol has a molecular weight of 304.35 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(E)-[(E)-(4-methoxyphenyl)methylidenehydrazinylidene]methyl]naphthalen-2-ol is sourced from PubChem (CID 135549426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).