hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol

C14H12N2O2 — CID 139057226

IUPAChydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol
SMILESOc1cc[c-]cc1/C=N/N=C/c1c[c-]ccc1O.[H+].[H+]
InChIInChI=1S/C14H10N2O2/c17-13-7-3-1-5-11(13)9-15-16-10-12-6-2-4-8-14(12)18/h3-10,17-18H/q-2/p+2/b15-9+,16-10+
InChIKeyIGVCKGXOZDMRTI-KAVGSWPWSA-P
MW240.26 g/mol
LogP2.38
Rot. Bonds3

About hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol

hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol (PubChem CID 139057226) has the molecular formula C14H12N2O2 and a molecular weight of 240.26 g/mol. Its IUPAC name is hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol.

Molecular Properties

Compound Namehydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol
PubChem CID139057226
Molecular FormulaC14H12N2O2
Molecular Weight240.26 g/mol
Exact Mass240.09
IUPAC Namehydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol
SMILESOc1cc[c-]cc1/C=N/N=C/c1c[c-]ccc1O.[H+].[H+]
InChIInChI=1S/C14H10N2O2/c17-13-7-3-1-5-11(13)9-15-16-10-12-6-2-4-8-14(12)18/h3-10,17-18H/q-2/p+2/b15-9+,16-10+
InChIKeyIGVCKGXOZDMRTI-KAVGSWPWSA-P
XLogP2.38
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.26
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenol_A(479)', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', '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 hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol?
The IUPAC name of hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol (CID 139057226) is hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol.
What is the SMILES notation for hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol?
The canonical SMILES for hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol is Oc1cc[c-]cc1/C=N/N=C/c1c[c-]ccc1O.[H+].[H+].
What is the InChIKey of hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol?
The InChIKey is IGVCKGXOZDMRTI-KAVGSWPWSA-P. The full InChI is InChI=1S/C14H10N2O2/c17-13-7-3-1-5-11(13)9-15-16-10-12-6-2-4-8-14(12)18/h3-10,17-18H/q-2/p+2/b15-9+,16-10+.
What are the key properties of hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol?
hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol has a molecular weight of 240.26 g/mol, XLogP of 2.38, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for hydron;2-[(E)-[(E)-(2-hydroxybenzene-5-id-1-yl)methylidenehydrazinylidene]methyl]benzene-4-id-1-ol is sourced from PubChem (CID 139057226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).