sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate

C15H21N2NaO4 — CID 171775960

IUPACsodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate
SMILESO=C([O-])CCCCCCCNNC(=O)c1ccccc1O.[Na+]
InChIInChI=1S/C15H22N2O4.Na/c18-13-9-6-5-8-12(13)15(21)17-16-11-7-3-1-2-4-10-14(19)20;/h5-6,8-9,16,18H,1-4,7,10-11H2,(H,17,21)(H,19,20);/q;+1/p-1
InChIKeyMUFBPZLGAVDDLQ-UHFFFAOYSA-M
MW316.33 g/mol
LogP-2.28
Rot. Bonds10

About sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate

sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate (PubChem CID 171775960) has the molecular formula C15H21N2NaO4 and a molecular weight of 316.33 g/mol. Its IUPAC name is sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate.

Molecular Properties

Compound Namesodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate
PubChem CID171775960
Molecular FormulaC15H21N2NaO4
Molecular Weight316.33 g/mol
Exact Mass316.14
IUPAC Namesodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate
SMILESO=C([O-])CCCCCCCNNC(=O)c1ccccc1O.[Na+]
InChIInChI=1S/C15H22N2O4.Na/c18-13-9-6-5-8-12(13)15(21)17-16-11-7-3-1-2-4-10-14(19)20;/h5-6,8-9,16,18H,1-4,7,10-11H2,(H,17,21)(H,19,20);/q;+1/p-1
InChIKeyMUFBPZLGAVDDLQ-UHFFFAOYSA-M
XLogP-2.28
TPSA101.49 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.33
LogP ≤ 5-2.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

10-[(2-hydroxybenzoyl)amino]decanoate
CID 145137506
azanium 8-[(2-hydroxybenzoyl)amino]octanoate
CID 171364107
disodium;10-(2-hydroxyphenyl)-10-oxodecanoate;12-(2-hydroxyphenyl)-12-oxododecanoate;sulfane
CID 158243902
2-hydroxy-N-(10-oxoundecyl)benzamide
CID 21335630
2-hydroxy-N-[8-(methylamino)-8-oxooctyl]benzamide
CID 167022462
disodium;ethanol;hydride;10-[(2-hydroxybenzoyl)amino]decanoic acid
CID 173066251
sodium 6-[[(2-hydroxyphenyl)-phenylmethylidene]amino]hexanoate
CID 135770205
2-hydroxy-N-(11-nitroso-11-oxoundecyl)benzamide
CID 163501379
methyl 6-[[(2-hydroxybenzoyl)amino]carbamothioylamino]hexanoate
CID 8669515
N'-(2,2-dimethylpropyl)-2-hydroxybenzohydrazide
CID 1275966
1-N',3-N'-bis(2-hydroxybenzoyl)propanedihydrazide
CID 21348404
sodium 6-(phenylmethoxycarbonylamino)hexanoate
CID 102088654

Frequently Asked Questions

What is the IUPAC name of sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate?
The IUPAC name of sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate (CID 171775960) is sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate.
What is the SMILES notation for sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate?
The canonical SMILES for sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate is O=C([O-])CCCCCCCNNC(=O)c1ccccc1O.[Na+].
What is the InChIKey of sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate?
The InChIKey is MUFBPZLGAVDDLQ-UHFFFAOYSA-M. The full InChI is InChI=1S/C15H22N2O4.Na/c18-13-9-6-5-8-12(13)15(21)17-16-11-7-3-1-2-4-10-14(19)20;/h5-6,8-9,16,18H,1-4,7,10-11H2,(H,17,21)(H,19,20);/q;+1/p-1.
What are the key properties of sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate?
sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate has a molecular weight of 316.33 g/mol, XLogP of -2.28, 10 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for sodium 8-[2-(2-hydroxybenzoyl)hydrazinyl]octanoate is sourced from PubChem (CID 171775960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).