N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide

C18H18N2O2 — CID 4052654

IUPACN'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide
SMILESO=C(NNC1=CCCCc2ccccc21)c1ccccc1O
InChIInChI=1S/C18H18N2O2/c21-17-12-6-4-10-15(17)18(22)20-19-16-11-5-2-8-13-7-1-3-9-14(13)16/h1,3-4,6-7,9-12,19,21H,2,5,8H2,(H,20,22)
InChIKeyILMDUBMXFVIAGD-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.00
Rot. Bonds3

About N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide

N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide (PubChem CID 4052654) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide.

Molecular Properties

Compound NameN'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide
PubChem CID4052654
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC NameN'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide
SMILESO=C(NNC1=CCCCc2ccccc21)c1ccccc1O
InChIInChI=1S/C18H18N2O2/c21-17-12-6-4-10-15(17)18(22)20-19-16-11-5-2-8-13-7-1-3-9-14(13)16/h1,3-4,6-7,9-12,19,21H,2,5,8H2,(H,20,22)
InChIKeyILMDUBMXFVIAGD-UHFFFAOYSA-N
XLogP3.00
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

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benzene;N-(3,4-dihydronaphthalen-1-yl)acetamide
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CID 2392794
1-N',3-N'-bis(2-hydroxybenzoyl)propanedihydrazide
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cyclopenten-1-ylmethyl 2-hydroxybenzoate
CID 154511016
N'-(cyclohepten-1-yl)-2-pyrrol-1-ylbenzohydrazide
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CID 91440405

Frequently Asked Questions

What is the IUPAC name of N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide?
The IUPAC name of N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide (CID 4052654) is N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide.
What is the SMILES notation for N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide?
The canonical SMILES for N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide is O=C(NNC1=CCCCc2ccccc21)c1ccccc1O.
What is the InChIKey of N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide?
The InChIKey is ILMDUBMXFVIAGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c21-17-12-6-4-10-15(17)18(22)20-19-16-11-5-2-8-13-7-1-3-9-14(13)16/h1,3-4,6-7,9-12,19,21H,2,5,8H2,(H,20,22).
What are the key properties of N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide?
N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide has a molecular weight of 294.35 g/mol, XLogP of 3.00, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(8,9-dihydro-7H-benzo[7]annulen-5-yl)-2-hydroxybenzohydrazide is sourced from PubChem (CID 4052654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).