N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide

C14H20N2O4 — CID 47365652

IUPACN'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide
SMILESCOCCOCCCC(=O)NNC(=O)c1ccccc1
InChIInChI=1S/C14H20N2O4/c1-19-10-11-20-9-5-8-13(17)15-16-14(18)12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3,(H,15,17)(H,16,18)
InChIKeyGIOCMSRIFJFVOJ-UHFFFAOYSA-N
MW280.32 g/mol
LogP0.89
Rot. Bonds8

About N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide

N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide (PubChem CID 47365652) has the molecular formula C14H20N2O4 and a molecular weight of 280.32 g/mol. Its IUPAC name is N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide.

Molecular Properties

Compound NameN'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide
PubChem CID47365652
Molecular FormulaC14H20N2O4
Molecular Weight280.32 g/mol
Exact Mass280.14
IUPAC NameN'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide
SMILESCOCCOCCCC(=O)NNC(=O)c1ccccc1
InChIInChI=1S/C14H20N2O4/c1-19-10-11-20-9-5-8-13(17)15-16-14(18)12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3,(H,15,17)(H,16,18)
InChIKeyGIOCMSRIFJFVOJ-UHFFFAOYSA-N
XLogP0.89
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.32
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-octanoylbenzohydrazide
CID 4227469
N'-heptanoylbenzohydrazide
CID 4218130
N'-nonanoylbenzohydrazide
CID 5163159
3,4-dimethoxy-N'-[4-(2-phenylethoxy)butanoyl]benzohydrazide
CID 55833812
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butane;methyl benzoate
CID 146469280
4-fluoro-N'-(4-phenoxybutanoyl)benzohydrazide
CID 7732785
N'-[4-(3-bromophenoxy)butanoyl]benzohydrazide
CID 7969162
tert-butyl N-[4-(2-benzoylhydrazinyl)-4-oxobutyl]carbamate
CID 9471691
N'-[3-(4-methylphenoxy)propanoyl]benzohydrazide
CID 7969097
N'-(4-cyclohexylbutanoyl)benzohydrazide
CID 9414897
4-(diethylamino)-N'-(4-phenoxybutanoyl)benzohydrazide
CID 9156259
4-(2-benzoylhydrazinyl)-4-oxobutanoate
CID 2165242

Frequently Asked Questions

What is the IUPAC name of N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide?
The IUPAC name of N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide (CID 47365652) is N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide.
What is the SMILES notation for N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide?
The canonical SMILES for N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide is COCCOCCCC(=O)NNC(=O)c1ccccc1.
What is the InChIKey of N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide?
The InChIKey is GIOCMSRIFJFVOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O4/c1-19-10-11-20-9-5-8-13(17)15-16-14(18)12-6-3-2-4-7-12/h2-4,6-7H,5,8-11H2,1H3,(H,15,17)(H,16,18).
What are the key properties of N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide?
N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide has a molecular weight of 280.32 g/mol, XLogP of 0.89, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[4-(2-methoxyethoxy)butanoyl]benzohydrazide is sourced from PubChem (CID 47365652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).